data_2ksn_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 2ksn _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.544 ' O ' ' HB ' ' A' ' 99' ' ' THR . 2.4 ppt_? . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -94.89 149.2 21.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.76 ' HG3' ' HA2' ' A' ' 103' ' ' GLY . 7.9 tt0 -83.62 119.09 73.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -165.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.52 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 5.8 Cg_exo -78.6 -164.53 0.28 Allowed 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.876 3.051 . . . . 0.0 112.125 171.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp -52.3 132.78 34.46 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 122.777 0.431 . . . . 0.0 111.183 178.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.721 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -80.76 87.81 5.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.273 0.559 . . . . 0.0 111.435 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.653 ' HD2' ' N ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -98.5 -25.06 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.106 175.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.653 ' N ' ' HD2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -50.73 151.32 2.45 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.389 -178.326 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.68 ' HD2' ' H ' ' A' ' 36' ' ' LYS . 1.2 mptt -96.05 159.95 31.06 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.681 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.54 ' HB2' ' CG1' ' A' ' 120' ' ' VAL . 13.8 Cg_exo -67.44 135.88 37.93 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.88 1.72 . . . . 0.0 111.063 174.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.653 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 32.5 ttpt -111.71 141.47 45.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.276 -0.42 . . . . 0.0 112.078 -168.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 1.063 ' HE1' HG23 ' A' ' 120' ' ' VAL . 3.1 p-90 147.51 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 O-C-N 125.281 1.613 . . . . 0.0 110.357 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.591 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.73 171.28 7.68 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.042 -176.847 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.64 ' HG ' ' HB3' ' A' ' 53' ' ' LYS . 15.0 m -64.61 133.28 51.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.776 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -71.43 -31.86 67.7 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -129.51 85.24 59.38 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.84 170.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.49 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 4.3 Cg_exo -75.86 134.23 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.417 2.078 . . . . 0.0 110.534 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.681 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 90.8 mtp -102.98 -81.99 0.5 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.963 0.411 . . . . 0.0 110.699 -178.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.4 p -115.37 -177.12 3.07 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.218 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -53.14 -49.64 66.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.263 0.352 . . . . 0.0 111.197 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.57 -48.03 84.16 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.127 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.681 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 75.3 mm-40 -61.82 -45.08 95.38 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.98 -57.35 13.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.621 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.436 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.8 ptm180 -63.51 -45.05 92.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.6 m -64.79 -53.02 53.59 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 121.23 -0.188 . . . . 0.0 111.013 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.64 ' HB3' ' HG ' ' A' ' 41' ' ' SER . 0.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.419 -0.513 . . . . 0.0 111.269 179.562 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.542 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 45.6 ttp180 -53.34 -53.52 49.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.658 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -66.26 -43.71 85.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.69 -177.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -51.7 -52.24 49.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.241 176.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -71.38 -36.86 71.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.69 0.281 . . . . 0.0 110.728 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.542 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -49.83 -41.61 45.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.587 176.539 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -58.22 -28.57 64.97 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.723 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.7 m -103.05 -0.22 31.07 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.458 -172.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.817 ' HB1' ' HD3' ' A' ' 62' ' ' PRO . . . -75.58 -75.58 0.1 OUTLIER Pre-proline 0 CA--C 1.544 0.737 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -173.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.817 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 77.7 Cg_endo . . . . . 0 C--N 1.352 0.73 0 C-N-CA 121.389 1.392 . . . . 0.0 113.478 -167.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.404 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.447 -0.569 0 N-CA-C 114.375 0.51 . . . . 0.0 114.375 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.768 ' HB3' HG21 ' A' ' 70' ' ' ILE . 13.1 tpt180 -155.76 106.95 2.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.729 0.299 . . . . 0.0 110.385 -169.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.487 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 75.7 mmtt -63.76 -28.36 69.83 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.351 0.596 . . . . 0.0 109.708 174.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.55 ' HB2' ' HG3' ' A' ' 67' ' ' ARG . 18.1 mm-40 -59.63 -40.15 86.66 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.634 177.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.768 HG21 ' HB3' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -82.68 -23.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.991 -178.586 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.67 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -48.71 -38.42 21.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.799 -177.258 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -52.6 -40.98 63.25 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.196 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 -32.91 59.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.266 0.555 . . . . 0.0 110.294 -176.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.573 HD22 HD13 ' A' ' 70' ' ' ILE . 32.4 mt -68.4 -43.72 76.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.929 -175.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.3 ptpt -74.56 -30.45 61.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.451 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.36 -35.68 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.967 0.413 . . . . 0.0 110.483 175.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.0 -45.09 75.06 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.352 176.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.561 ' HA ' HD12 ' A' ' 105' ' ' LEU . . . -50.04 -39.33 41.54 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.57 0.544 . . . . 0.0 110.805 171.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.429 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 71.3 t60 -60.9 -51.0 71.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.473 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.479 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.31 -50.03 69.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.774 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -60.25 -37.23 79.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.433 -177.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -60.46 -32.04 71.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 110.724 174.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 11.3 m -89.36 16.94 6.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.44 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 83' ' ' SER . 52.3 m-80 77.5 3.55 3.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.831 0.852 . . . . 0.0 111.741 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.521 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 7.3 m-20 -80.24 84.68 5.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 110.324 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.446 ' HD2' ' HG2' ' A' ' 33' ' ' LYS . 55.5 m80 -70.93 -43.24 68.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.972 178.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -63.75 -39.64 94.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.139 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 12.1 mt -60.11 -49.0 79.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.795 0.331 . . . . 0.0 110.823 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.642 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -64.54 -34.16 77.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.127 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -64.8 -44.64 89.27 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.723 0.297 . . . . 0.0 110.784 173.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . 0.502 ' O ' ' HA3' ' A' ' 95' ' ' GLY . . . -67.63 -21.26 65.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.909 -177.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.5 mt -83.3 -61.62 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.433 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 89' ' ' ALA . 7.9 mm -56.46 -62.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.517 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.599 ' OD1' ' HB3' ' A' ' 30' ' ' GLN . 3.5 m-20 -72.53 -14.59 61.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.358 -178.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . 0.502 ' HA3' ' O ' ' A' ' 91' ' ' ALA . . . -74.13 -21.62 78.82 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.174 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.513 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -83.01 -55.62 4.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 110.647 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.513 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 4.5 t-20 156.31 -30.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -176.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.961 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -54.24 137.05 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 112.936 -1.938 . . . . 0.0 110.947 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.544 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 11.2 p -144.57 174.14 11.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.324 0.583 . . . . 0.0 112.175 -175.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.728 HD13 ' O ' ' A' ' 107' ' ' GLU . 82.8 mt -145.73 137.31 12.94 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.463 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.33 -6.94 13.91 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.312 1.341 . . . . 0.0 110.45 164.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -80.79 -59.65 2.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.893 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . 0.76 ' HA2' ' HG3' ' A' ' 30' ' ' GLN . . . 95.19 40.74 4.19 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.083 -1.055 . . . . 0.0 111.912 -172.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.496 ' HB1' ' CB ' ' A' ' 35' ' ' GLU . . . -115.77 153.4 31.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.323 0.582 . . . . 0.0 111.476 -177.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 78' ' ' ALA . 2.0 tm? -91.25 -16.44 27.6 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.4 p -91.91 9.68 31.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.947 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.728 ' O ' HD13 ' A' ' 100' ' ' LEU . 27.6 mt-10 -145.59 151.96 38.93 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.504 ' SG ' HD21 ' A' ' 74' ' ' LEU . 94.4 m -155.86 138.73 15.3 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -115.73 123.06 47.33 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.717 0.77 . . . . 0.0 110.09 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ASP . . . . . 0.961 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.8 t70 -91.75 152.67 20.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.247 -1.342 . . . . 0.0 110.307 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.5 -23.43 65.91 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.244 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.416 ' HB2' ' ND2' ' A' ' 114' ' ' ASN . 21.4 mt -78.83 1.83 22.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.959 0.409 . . . . 0.0 111.014 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.67 26.81 12.4 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.941 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 90.2 m-20 -101.98 155.27 18.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.888 -173.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -138.52 137.46 37.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.084 0.469 . . . . 0.0 110.609 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . 0.493 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 13.0 m-85 -117.76 132.45 56.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.437 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 6.2 mm-40 -123.86 121.36 35.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 -176.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 33.9 tp -103.75 120.59 50.94 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -169.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.58 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 21.2 Cg_exo -71.38 156.42 58.64 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 123.869 3.046 . . . . 0.0 112.79 175.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 1.063 HG23 ' HE1' ' A' ' 39' ' ' TRP . 21.1 m -67.72 -18.75 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.896 -172.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 0.58 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 3.9 p90 -61.01 -18.13 56.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.843 0.354 . . . . 0.0 111.546 -170.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.9 t -103.44 -0.56 29.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.436 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -137.08 -54.35 0.7 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -175.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.459 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -135.11 119.34 13.4 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.517 -170.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.42 ' N ' ' CD ' ' A' ' 126' ' ' PRO . 68.7 Cg_endo -101.48 21.64 0.19 Allowed 'Trans proline' 0 CA--C 1.558 1.69 0 C-N-CA 122.945 2.43 . . . . 0.0 117.002 178.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.459 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 41.9 Cg_endo -70.04 -34.49 13.56 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-N 122.339 1.871 . . . . 0.0 111.897 175.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.745 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.236 0 CA-C-O 121.56 0.695 . . . . 0.0 110.852 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.677 ' O ' ' HB ' ' A' ' 99' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.924 0.392 . . . . 0.0 111.385 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.611 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 30.8 p-10 -108.91 158.7 17.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 170.062 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -80.27 111.32 21.38 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -162.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.616 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 4.8 Cg_exo -79.71 -164.57 0.29 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.743 2.962 . . . . 0.0 109.972 166.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.551 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 28.4 tp -52.74 132.06 35.82 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 176.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.535 ' HE3' ' CZ ' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -57.25 109.53 0.68 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.361 0.6 . . . . 0.0 111.319 -175.656 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.867 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 10.8 mmpt? -97.55 -19.86 18.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.053 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.19 170.07 8.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.493 0.664 . . . . 0.0 111.605 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -109.38 159.85 29.87 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.04 -177.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.491 ' HB2' ' CG1' ' A' ' 120' ' ' VAL . 33.1 Cg_exo -51.29 128.73 26.39 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.567 2.178 . . . . 0.0 112.294 -175.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.472 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 24.3 ttpt -113.46 123.21 49.5 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.253 -170.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 1.045 ' HE1' HG23 ' A' ' 120' ' ' VAL . 3.1 p-90 -176.3 25.17 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.666 -1.152 . . . . 0.0 109.441 172.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.449 ' HE2' HG23 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -157.59 166.02 34.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.979 -167.309 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 52.1 m -69.37 128.75 37.66 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 165.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -76.92 -18.31 58.37 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . 0.49 ' CE2' ' HG2' ' A' ' 45' ' ' MET . 51.2 t80 -133.34 75.0 71.05 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.215 170.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.497 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 50.4 Cg_exo -62.45 -26.36 76.47 Favored 'Trans proline' 0 CA--C 1.508 -0.809 0 C-N-CA 123.853 3.035 . . . . 0.0 113.549 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.49 ' HG2' ' CE2' ' A' ' 43' ' ' TYR . 54.1 mtt 78.18 -82.64 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.696 -1.593 . . . . 0.0 110.797 -177.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.3 p -115.69 175.85 5.34 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.102 -177.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.604 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 0.8 OUTLIER -68.12 -36.7 80.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.432 0.158 . . . . 0.0 110.618 -177.966 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.08 -41.94 94.83 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.167 -0.54 . . . . 0.0 111.863 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.715 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -74.46 -38.49 62.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.516 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.8 tp -54.48 -54.34 42.28 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.299 0.375 . . . . 0.0 111.15 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 14.9 ptm180 -64.51 -47.1 80.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.323 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.1 t -60.64 -45.35 94.38 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.684 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.485 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 65.5 mmtt -72.72 -30.09 63.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.495 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -57.94 -41.32 82.54 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.55 -50.64 35.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.438 0.637 . . . . 0.0 110.745 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -54.91 -46.85 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.633 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.485 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 34.0 m-85 -70.48 -36.43 73.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.467 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -30.58 48.0 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.388 0.43 . . . . 0.0 111.223 176.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -60.62 -34.25 73.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 112.074 173.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 m -100.0 -27.1 13.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.977 -171.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.499 ' HB1' ' HD3' ' A' ' 62' ' ' PRO . . . -52.1 -52.93 57.48 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -175.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.499 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 49.4 Cg_endo . . . . . 0 C--N 1.348 0.525 0 C-N-CA 122.166 1.911 . . . . 0.0 112.877 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.488 ' HA2' ' OD1' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.432 -1.609 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.589 ' O ' HG21 ' A' ' 70' ' ' ILE . 33.7 mmt180 -66.51 94.72 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 171.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.441 ' HD2' ' HA ' ' A' ' 68' ' ' LYS . 15.1 tptm -50.85 -37.11 41.29 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.793 -171.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -58.41 -33.43 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.752 HD13 HD22 ' A' ' 74' ' ' LEU . 0.8 OUTLIER -82.77 -22.52 8.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.229 -178.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.627 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -50.62 -37.2 38.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.808 -173.285 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -59.24 -34.24 71.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.326 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.22 -29.01 42.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.02 0.438 . . . . 0.0 110.091 -178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.752 HD22 HD13 ' A' ' 70' ' ' ILE . 34.2 mt -67.96 -49.27 62.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.467 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.627 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.4 ptpt -69.01 -28.99 67.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.708 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.74 -38.72 76.92 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.179 176.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.497 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -67.95 -51.35 48.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.618 178.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.403 ' HA ' HD12 ' A' ' 105' ' ' LEU . . . -51.54 -34.13 35.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 172.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.43 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 28.5 t60 -64.18 -47.55 79.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.133 0.492 . . . . 0.0 109.81 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -68.85 -53.46 21.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.535 ' CZ ' ' HE3' ' A' ' 33' ' ' LYS . 12.7 t80 -54.44 -28.5 44.55 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.802 177.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -63.17 -28.82 70.32 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.591 -0.693 . . . . 0.0 111.229 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.7 t -92.15 15.26 13.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.469 0.652 . . . . 0.0 109.455 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 57.4 t30 70.71 7.44 6.22 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.012 -178.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.425 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 4.7 m-20 -73.84 82.05 1.64 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.199 0.524 . . . . 0.0 110.441 176.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 -72.09 -37.25 69.61 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.458 174.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.412 ' HG3' ' N ' ' A' ' 88' ' ' LEU . 10.2 pt-20 -53.67 -43.7 69.07 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.699 178.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 92' ' ' ILE . 14.5 mt -65.65 -51.93 55.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.981 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.565 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -63.27 -40.11 96.47 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.92 -176.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -66.17 -38.78 88.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.772 0.32 . . . . 0.0 110.195 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.55 -21.0 61.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.666 -179.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.3 mt -81.84 -60.68 2.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.861 177.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.565 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -52.66 -61.81 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.416 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.26 -25.25 65.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.564 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -75.24 -12.61 83.41 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.951 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -102.07 6.63 41.09 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.987 -0.126 . . . . 0.0 110.881 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.8 t30 74.14 8.11 4.69 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.982 0.896 . . . . 0.0 109.525 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.937 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -90.51 138.2 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.348 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.677 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 19.8 p -123.19 164.79 18.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.362 -177.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.856 HD11 ' HB2' ' A' ' 102' ' ' HIS . 2.6 tm? -150.42 104.11 3.11 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.483 178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.603 ' HD2' HD21 ' A' ' 100' ' ' LEU . 67.4 Cg_endo -71.62 -7.9 22.12 Favored 'Trans proline' 0 N--CA 1.476 0.475 0 C-N-CA 123.325 2.684 . . . . 0.0 114.216 -173.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.856 ' HB2' HD11 ' A' ' 100' ' ' LEU . 29.7 m-70 -82.72 -15.45 51.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 177.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . 0.616 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 68.77 37.67 84.51 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.275 -176.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.672 ' H ' HD13 ' A' ' 100' ' ' LEU . . . -135.36 152.76 51.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 121.267 0.556 . . . . 0.0 111.572 -175.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.497 HD22 ' HB1' ' A' ' 77' ' ' ALA . 2.6 tm? -79.55 -21.92 44.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.279 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 118' ' ' LEU . 37.7 p -87.7 24.09 1.81 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.242 -173.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.788 ' HB3' HD22 ' A' ' 100' ' ' LEU . 32.5 mt-10 -156.07 149.56 24.76 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.429 ' SG ' HD21 ' A' ' 74' ' ' LEU . 74.8 m -151.31 139.44 20.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.04 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.486 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 12.5 m-30 -118.72 121.59 40.46 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.89 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ASP . . . . . 0.937 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.0 OUTLIER -84.5 145.12 28.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.106 178.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -58.6 -31.81 68.4 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 124.649 1.218 . . . . 0.0 111.835 -171.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 16.8 mt -69.36 -40.5 77.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.568 -177.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 141.75 43.6 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.766 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.839 ' HB3' ' HB3' ' A' ' 110' ' ' ASP . 1.8 t-20 -109.14 152.49 25.04 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.287 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.486 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 38.6 ttp180 -134.73 128.03 32.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.785 0.326 . . . . 0.0 110.31 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -117.37 137.97 52.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.808 177.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -122.29 119.45 31.18 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 106' ' ' THR . 4.0 mm? -95.53 115.34 65.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -170.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.545 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 33.7 Cg_exo -69.21 155.2 68.46 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 124.169 3.246 . . . . 0.0 113.622 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 1.045 HG23 ' HE1' ' A' ' 39' ' ' TRP . 11.1 m -72.69 -23.02 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 114.75 -1.114 . . . . 0.0 112.631 -171.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 0.545 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.6 p90 -55.95 -29.69 60.55 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -168.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.6 t -99.32 -1.71 38.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.598 0.237 . . . . 0.0 111.34 -175.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.3 mt -133.85 -71.38 0.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.975 -174.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.69 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -118.76 116.06 34.83 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.606 -170.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -104.16 32.61 0.06 OUTLIER 'Trans proline' 0 CA--C 1.556 1.582 0 C-N-CA 123.045 2.497 . . . . 0.0 116.539 177.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.73 -19.61 18.37 Favored 'Trans proline' 0 C--N 1.367 1.506 0 CA-C-N 121.945 1.73 . . . . 0.0 111.68 172.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.592 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.377 0 CA-C-O 121.471 0.653 . . . . 0.0 109.921 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.63 ' O ' ' HB ' ' A' ' 99' ' ' THR . 8.8 mtt180 . . . . . 0 CA--C 1.519 -0.217 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.548 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 8.7 p30 -109.67 161.51 15.32 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -176.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.601 ' HA ' ' HA2' ' A' ' 103' ' ' GLY . 26.2 tt0 -79.67 109.27 11.25 Favored Pre-proline 0 CA--C 1.534 0.331 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -165.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.943 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 73.2 Cg_endo -76.63 -165.29 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.335 2.69 . . . . 0.0 111.425 171.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.612 HD21 ' HE3' ' A' ' 34' ' ' LYS . 17.9 tp -48.33 138.06 10.38 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.189 0.518 . . . . 0.0 111.119 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.793 ' HG2' ' HB2' ' A' ' 105' ' ' LEU . 0.4 OUTLIER -76.9 94.15 3.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.874 -172.136 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.612 ' HE3' HD21 ' A' ' 32' ' ' LEU . 32.8 mmtp -98.68 -42.28 7.31 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HG2' ' HZ1' ' A' ' 38' ' ' LYS . 9.4 tp10 -68.66 156.45 38.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.638 0.732 . . . . 0.0 112.543 -169.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.488 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 35.7 mmtm -95.08 160.93 29.82 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.251 -179.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.777 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 20.6 Cg_exo -66.44 138.37 50.2 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.239 1.959 . . . . 0.0 112.41 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.72 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 3.7 mtmt -110.76 148.98 31.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.847 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 1.01 ' HE1' HG23 ' A' ' 120' ' ' VAL . 0.8 OUTLIER 125.64 -4.52 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.105 0 O-C-N 126.047 2.092 . . . . 0.0 108.945 -171.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.778 ' HZ1' ' HB3' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -115.94 151.9 34.5 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.563 -167.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.538 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 58.4 m -64.98 149.08 50.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.456 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -56.81 -50.57 71.98 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -139.22 102.6 7.38 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.548 171.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.532 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 15.0 Cg_exo -67.88 131.63 24.53 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.077 1.851 . . . . 0.0 109.828 172.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.401 ' HB3' ' H ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -91.76 -81.3 0.33 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.742 -175.417 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.401 ' H ' ' HB3' ' A' ' 45' ' ' MET . 43.1 p -115.17 -175.52 2.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.894 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.13 -36.53 79.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.788 0.328 . . . . 0.0 111.133 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.519 ' O ' ' HG2' ' A' ' 51' ' ' ARG . . . -63.07 -42.14 99.64 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.881 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -68.16 -37.7 81.3 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.47 -55.33 35.97 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.029 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 48' ' ' GLY . 5.9 ptp180 -58.7 -46.99 86.07 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.754 0.311 . . . . 0.0 111.756 -176.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.466 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 74.2 m -67.35 -52.06 44.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.171 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -66.64 -32.67 74.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.242 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 54' ' ' ARG . 11.0 ttm180 -55.41 -48.29 74.6 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.22 -47.99 77.56 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.654 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 52' ' ' SER . 59.8 mt-10 -52.64 -48.47 66.39 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.762 177.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -66.1 -40.33 90.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.574 178.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.449 ' HA ' ' HB2' ' A' ' 61' ' ' ALA . 7.1 m95 -54.1 -31.36 51.81 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 177.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -66.96 -19.07 65.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.855 0.359 . . . . 0.0 111.27 176.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.8 m -108.27 -16.46 14.24 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.603 0.716 . . . . 0.0 110.224 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.836 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -76.88 169.61 20.34 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.303 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.836 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 36.0 Cg_endo . . . . . 0 C--N 1.346 0.439 0 C-N-CA 122.546 2.164 . . . . 0.0 113.069 -176.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.806 0 N-CA-C 112.722 -0.151 . . . . 0.0 112.722 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.482 ' O ' HG23 ' A' ' 70' ' ' ILE . 5.3 mmp_? -143.36 126.62 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 122.72 0.408 . . . . 0.0 109.992 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -71.02 -26.82 63.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.084 0.469 . . . . 0.0 110.072 176.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -60.53 -43.1 97.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.945 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.773 HD11 ' HB2' ' A' ' 110' ' ' ASP . 0.0 OUTLIER -80.8 -23.42 10.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.189 -176.637 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.558 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 2.0 m95 -52.5 -37.11 56.62 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -177.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -58.11 -35.36 71.33 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.278 0.361 . . . . 0.0 111.08 -177.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.25 -29.85 57.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.108 0.48 . . . . 0.0 110.555 -178.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.509 HD22 ' CD1' ' A' ' 70' ' ' ILE . 16.8 mt -67.72 -53.4 27.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.185 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.7 ptpt -65.13 -30.42 71.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.898 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.406 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.84 -36.97 76.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.103 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.08 -50.38 48.86 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.601 0.239 . . . . 0.0 110.438 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -31.92 61.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.406 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 24.5 t60 -63.78 -47.37 81.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 109.846 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -70.99 -52.37 20.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.827 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.548 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 21.0 t80 -57.28 -35.14 69.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.486 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.06 -27.13 68.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.943 0.401 . . . . 0.0 111.322 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -94.97 22.11 6.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.28 177.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.6 m120 77.02 0.96 3.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.648 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.756 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 2.0 m-20 -77.46 84.37 3.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.321 0.581 . . . . 0.0 110.705 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.422 ' HD2' ' HD2' ' A' ' 33' ' ' LYS . 60.0 m80 -71.92 -39.68 69.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.947 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.523 ' HA ' ' NE2' ' A' ' 90' ' ' GLN . 11.5 pt-20 -69.82 -37.71 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.385 -177.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.756 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -62.99 -51.22 67.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.931 0.396 . . . . 0.0 110.768 -179.846 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.807 ' HB3' HD21 ' A' ' 105' ' ' LEU . . . -62.34 -46.43 88.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.576 -175.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.523 ' NE2' ' HA ' ' A' ' 87' ' ' GLU . 10.7 pt20 -63.79 -34.46 77.96 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.59 0.233 . . . . 0.0 110.528 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.17 -26.61 62.15 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.918 0.39 . . . . 0.0 110.557 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.8 mt -72.01 -47.06 56.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 174.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.773 HG22 HG22 ' A' ' 98' ' ' ILE . 9.7 mm -49.8 -61.83 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.529 173.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.166 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.56 -23.9 70.71 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.44 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.53 ' HB1' HD12 ' A' ' 98' ' ' ILE . . . -99.97 9.27 43.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.154 -178.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 62.6 t30 69.85 11.93 7.85 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.83 1.3 . . . . 0.0 108.882 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.773 HG22 HG22 ' A' ' 93' ' ' ILE . 51.2 mt -83.88 141.0 15.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 113.343 -1.753 . . . . 0.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.63 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 30.0 p -134.5 168.6 18.66 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.101 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 108' ' ' CYS . 4.0 mt -150.2 106.5 3.17 Favored Pre-proline 0 N--CA 1.449 -0.506 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.05 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.508 ' HD2' ' CD2' ' A' ' 109' ' ' TYR . 24.9 Cg_endo -63.14 -26.36 72.89 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 121.431 1.421 . . . . 0.0 110.574 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -77.23 -20.89 54.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.798 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . 0.943 ' HA3' ' HD2' ' A' ' 31' ' ' PRO . . . 55.96 38.26 74.27 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 114.819 -1.082 . . . . 0.0 114.18 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -110.93 149.21 30.97 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.756 0.313 . . . . 0.0 110.978 -177.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 89' ' ' ALA . 0.3 OUTLIER -78.84 -24.41 44.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.777 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 47.4 p -85.21 26.82 0.85 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.583 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' A' ' 117' ' ' GLN . 20.1 mt-10 -165.48 156.98 14.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.261 175.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.531 ' HA ' HD22 ' A' ' 100' ' ' LEU . 86.9 m -156.22 139.86 15.99 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 172.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.508 ' CD2' ' HD2' ' A' ' 101' ' ' PRO . 18.3 m-30 -116.87 121.98 43.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.972 0.891 . . . . 0.0 110.266 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ASP . . . . . 0.862 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 3.5 t70 -80.48 149.07 30.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.249 -177.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -59.66 -25.97 65.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.933 -1.03 . . . . 0.0 112.714 -168.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -74.8 -9.6 58.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.208 0.528 . . . . 0.0 110.642 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.16 26.04 6.17 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.95 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.862 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 64.5 m-80 -94.73 150.24 20.41 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.409 ' HA ' ' HD1' ' A' ' 109' ' ' TYR . 10.3 ptp180 -123.37 144.69 49.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.045 0.45 . . . . 0.0 109.881 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -136.01 142.45 44.47 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.155 174.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.464 ' HA ' ' HG2' ' A' ' 107' ' ' GLU . 45.7 mt-30 -122.31 119.9 32.49 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.67 112.5 45.13 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.45 -171.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.566 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 37.0 Cg_exo -69.16 154.71 69.68 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.586 2.857 . . . . 0.0 113.404 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 1.01 HG23 ' HE1' ' A' ' 39' ' ' TRP . 32.6 m -61.52 -16.82 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.94 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 0.566 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.7 p90 -59.24 -21.02 58.91 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -169.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 20.6 t -126.88 14.44 7.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.013 0.435 . . . . 0.0 110.688 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.651 HD12 HG22 ' A' ' 106' ' ' THR . 65.7 mt -132.54 -53.04 0.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.949 0.404 . . . . 0.0 111.902 -176.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.563 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -128.05 114.88 20.33 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-O 120.712 0.291 . . . . 0.0 110.953 -173.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.434 ' N ' ' CD ' ' A' ' 126' ' ' PRO . 75.6 Cg_endo -96.99 16.21 0.7 Allowed 'Trans proline' 0 CA--C 1.558 1.719 0 C-N-CA 123.012 2.475 . . . . 0.0 117.162 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.563 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 39.9 Cg_endo -68.66 -16.32 42.13 Favored 'Trans proline' 0 C--N 1.371 1.742 0 CA-C-N 122.486 1.924 . . . . 0.0 111.656 173.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.591 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.202 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.655 HH11 ' HB3' ' A' ' 29' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 121.426 0.631 . . . . 0.0 110.401 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.655 ' HB3' HH11 ' A' ' 28' ' ' ARG . 4.9 p-10 -97.28 160.33 14.39 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.753 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -81.37 106.29 5.57 Favored Pre-proline 0 C--N 1.326 -0.431 0 O-C-N 123.589 0.555 . . . . 0.0 112.36 -169.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.687 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 91.4 Cg_endo -79.59 -164.99 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 123.284 2.656 . . . . 0.0 111.222 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.2 mp -50.58 137.65 19.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.785 0.326 . . . . 0.0 110.757 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.711 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -75.43 100.62 4.53 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.375 1.083 . . . . 0.0 111.201 -171.007 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -98.4 -19.14 17.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.228 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.804 ' HB3' ' HB1' ' A' ' 104' ' ' ALA . 4.0 tp10 -95.67 149.26 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.091 0.472 . . . . 0.0 110.751 -174.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -98.73 161.47 24.91 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.617 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.679 ' HG3' HG23 ' A' ' 106' ' ' THR . 32.0 Cg_exo -55.58 142.23 81.98 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.617 2.211 . . . . 0.0 112.995 -177.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.654 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 36.2 ttpt -111.54 135.69 51.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.384 -170.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 1.093 ' HE1' HG23 ' A' ' 120' ' ' VAL . 1.4 p-90 152.01 -17.25 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.792 1.307 . . . . 0.0 110.961 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.459 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.41 164.51 13.51 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.573 0.225 . . . . 0.0 110.881 -174.664 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 39.7 m -65.27 119.73 11.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.839 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . 0.406 ' HA ' ' HZ2' ' A' ' 40' ' ' LYS . 16.3 t0 -67.5 -28.76 68.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -126.18 89.77 51.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.369 167.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.16 137.12 13.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.973 2.449 . . . . 0.0 112.262 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.498 ' HB3' ' H ' ' A' ' 46' ' ' THR . 12.4 mmm -108.03 -137.64 0.37 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 174.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.498 ' H ' ' HB3' ' A' ' 45' ' ' MET . 47.5 p -81.03 -175.19 5.28 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.783 -177.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 21.0 t70 -56.69 -49.58 74.69 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -168.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.07 -36.14 91.85 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.706 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -72.37 -44.17 62.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 0.0 110.263 175.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 50.6 tp -60.3 -45.52 93.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.807 -178.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 12.4 ptp180 -64.68 -50.84 65.42 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.455 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 26.7 t -64.07 -57.38 9.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.693 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 57' ' ' PHE . 2.0 tppt? -63.99 -28.05 69.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.138 -174.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 40.5 ttm180 -58.1 -45.65 86.86 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 172.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.2 -49.32 61.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 2.0 mp0 -50.36 -47.36 56.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.541 0.686 . . . . 0.0 110.495 174.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -69.4 -38.81 78.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.832 -179.246 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.503 ' CE3' ' HB2' ' A' ' 61' ' ' ALA . 2.3 m95 -53.2 -29.48 32.24 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.417 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 9.4 t70 -58.15 -27.16 63.54 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.492 0.663 . . . . 0.0 110.767 172.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.9 m -105.59 13.16 30.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.542 0.687 . . . . 0.0 110.096 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.976 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -99.33 175.81 2.26 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.976 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 31.6 Cg_endo . . . . . 0 C--N 1.365 1.419 0 C-N-CA 124.657 3.571 . . . . 0.0 116.001 -170.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.582 0 N-CA-C 111.555 -0.618 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.625 ' O ' HG21 ' A' ' 70' ' ' ILE . 4.0 mmp_? -108.74 96.13 6.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 110.54 -0.17 . . . . 0.0 110.54 177.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.538 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 16.7 tptm -45.74 -35.09 4.03 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.222 0.609 . . . . 0.0 111.726 178.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -50.57 -40.25 51.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.12 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.632 HD13 HD22 ' A' ' 74' ' ' LEU . 0.9 OUTLIER -82.83 -22.1 9.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -175.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.538 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.09 -40.18 14.7 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 122.866 0.467 . . . . 0.0 111.881 -171.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.91 -36.84 70.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.581 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.61 -26.04 45.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.159 0.504 . . . . 0.0 110.296 -176.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.632 HD22 HD13 ' A' ' 70' ' ' ILE . 51.4 mt -70.29 -46.31 64.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.611 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.708 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -72.71 -25.85 61.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.716 177.179 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.425 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -68.26 -39.67 82.14 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.726 0.298 . . . . 0.0 110.702 174.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.8 -47.35 75.4 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.483 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.671 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -49.96 -39.65 41.33 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.597 171.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.425 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 22.3 t60 -62.33 -47.69 83.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.224 -178.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.618 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -65.12 -53.95 37.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 177.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.615 ' HE1' ' HE3' ' A' ' 33' ' ' LYS . 9.6 t80 -53.94 -30.51 46.84 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.423 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.0 mt-10 -56.64 -40.66 75.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 175.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -84.96 20.34 1.88 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.463 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.7 t30 71.59 9.65 6.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.217 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.618 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 2.5 t0 -80.79 83.77 6.47 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.489 0.661 . . . . 0.0 110.536 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -72.56 -41.55 65.61 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.094 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.08 -43.8 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.286 -176.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.481 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.0 mt -55.58 -52.79 62.57 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 120.802 0.334 . . . . 0.0 110.771 175.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.629 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -61.74 -47.3 85.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.792 -176.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -27.67 65.71 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.61 -177.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -74.76 -32.56 62.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.846 0.355 . . . . 0.0 110.254 176.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.3 mt -68.76 -57.2 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.349 176.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.629 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -51.03 -61.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.208 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.415 ' HA ' ' O ' ' A' ' 98' ' ' ILE . 21.1 t70 -71.33 -18.25 62.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.252 -174.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.96 -11.52 70.02 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.121 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -108.93 8.68 26.52 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.097 -0.061 . . . . 0.0 111.029 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.1 m-80 72.95 4.34 4.94 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.313 0.578 . . . . 0.0 110.392 -173.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 1.145 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -83.73 134.88 25.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.736 172.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.529 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 21.3 p -138.97 166.36 24.69 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.772 -177.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.708 HD13 ' H ' ' A' ' 104' ' ' ALA . 2.4 tm? -148.12 104.34 3.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.743 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.492 ' HD2' HD21 ' A' ' 100' ' ' LEU . 32.1 Cg_endo -63.81 -30.54 68.5 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.195 2.597 . . . . 0.0 113.779 -173.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.54 ' HB2' HD11 ' A' ' 100' ' ' LEU . 13.0 m-70 -68.29 -9.55 48.45 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.67 0.272 . . . . 0.0 111.671 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . 0.711 ' O ' ' HA ' ' A' ' 33' ' ' LYS . . . 73.49 18.29 79.34 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.328 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.804 ' HB1' ' HB3' ' A' ' 35' ' ' GLU . . . -95.01 140.31 30.15 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.511 0.672 . . . . 0.0 111.373 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' A' ' 78' ' ' ALA . 2.5 tm? -83.15 -16.34 47.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.184 175.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.679 HG23 ' HG3' ' A' ' 37' ' ' PRO . 59.8 p -91.07 14.99 12.51 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.05 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.527 ' HB3' HD22 ' A' ' 100' ' ' LEU . 28.9 mt-10 -149.84 144.71 26.14 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 78.9 m -150.86 138.33 19.56 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 175.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.436 ' CD1' ' HG2' ' A' ' 115' ' ' ARG . 16.3 m-30 -116.93 122.5 44.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.511 0.672 . . . . 0.0 109.533 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ASP . . . . . 1.145 ' HA ' HG13 ' A' ' 98' ' ' ILE . 2.6 t70 -81.38 148.29 29.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.021 -173.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -55.26 -27.74 48.56 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 124.551 1.157 . . . . 0.0 112.645 -171.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.4 mt -78.95 -7.37 57.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.944 0.402 . . . . 0.0 110.874 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 23.44 7.27 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.182 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.98 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 59.1 m-80 -92.58 161.63 14.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.779 0.323 . . . . 0.0 110.904 -176.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.436 ' HG2' ' CD1' ' A' ' 109' ' ' TYR . 78.0 mtt180 -129.82 128.13 41.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.07 0.462 . . . . 0.0 111.187 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . 0.592 ' HE1' ' H ' ' A' ' 67' ' ' ARG . 20.2 m-85 -117.98 124.06 47.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.715 171.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -123.88 121.14 34.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.048 -171.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.572 HD22 HG22 ' A' ' 106' ' ' THR . 38.0 tp -98.99 119.82 59.96 Favored Pre-proline 0 C--N 1.319 -0.757 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -170.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.621 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 24.5 Cg_exo -69.38 156.2 65.03 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.313 2.675 . . . . 0.0 112.739 174.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 1.093 HG23 ' HE1' ' A' ' 39' ' ' TRP . 33.7 m -66.81 -15.79 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.273 -175.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 0.621 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.3 p90 -58.67 -21.65 54.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.944 0.402 . . . . 0.0 111.865 -172.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 37.0 t -101.61 2.4 38.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.179 -175.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 61.9 mt -139.6 -52.05 0.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.447 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -137.37 114.37 9.67 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.991 -173.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -103.3 27.19 0.1 OUTLIER 'Trans proline' 0 CA--C 1.555 1.556 0 C-N-CA 122.973 2.448 . . . . 0.0 117.043 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.418 ' HD2' HD11 ' A' ' 127' ' ' ILE . 80.7 Cg_endo -81.35 -19.04 8.09 Favored 'Trans proline' 0 C--N 1.365 1.428 0 CA-C-N 122.268 1.846 . . . . 0.0 112.205 173.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.655 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 121.257 0.551 . . . . 0.0 110.442 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.742 ' O ' ' HB ' ' A' ' 99' ' ' THR . 22.1 mmm180 . . . . . 0 N--CA 1.446 -0.669 0 CA-C-O 121.081 0.467 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.418 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 28.0 p-10 -90.11 156.38 18.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.337 -174.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.673 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 9.0 pt20 -90.46 117.26 67.87 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -169.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.601 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.0 Cg_exo -70.18 -163.59 0.12 Allowed 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.959 3.106 . . . . 0.0 112.172 170.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.25 139.01 15.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.857 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.897 ' HZ3' ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -107.47 104.98 14.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.713 -170.057 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.569 ' O ' ' HD3' ' A' ' 34' ' ' LYS . 11.8 tmtt? -99.14 -24.12 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.51 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.601 ' OE1' ' HB3' ' A' ' 102' ' ' HIS . 44.3 mt-10 -71.39 167.4 19.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.524 0.678 . . . . 0.0 112.226 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.461 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -105.86 152.9 40.34 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.328 -166.22 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.755 ' HG3' HG23 ' A' ' 106' ' ' THR . 24.8 Cg_exo -62.01 144.88 96.74 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.021 2.481 . . . . 0.0 111.913 177.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 18.3 ttpp -112.22 115.88 29.53 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -168.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.936 ' HE1' HG12 ' A' ' 120' ' ' VAL . 1.1 p-90 170.71 20.84 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 113.2 -1.818 . . . . 0.0 109.966 173.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.552 ' HD2' ' O ' ' A' ' 41' ' ' SER . 1.6 tmmt? -128.34 147.97 50.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.04 0.448 . . . . 0.0 110.733 -159.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.602 ' HG ' ' HG2' ' A' ' 53' ' ' LYS . 58.2 m -64.62 140.31 58.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.571 -175.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.97 -39.36 74.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.678 175.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -140.99 92.22 8.68 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.053 171.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.57 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 7.4 Cg_exo -72.42 134.58 22.85 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.477 2.118 . . . . 0.0 110.502 175.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.431 ' HB3' ' H ' ' A' ' 46' ' ' THR . 5.1 ttp -112.66 -86.12 0.57 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.254 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.431 ' H ' ' HB3' ' A' ' 45' ' ' MET . 46.4 p -117.67 -173.81 2.5 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.455 ' OD2' ' HD2' ' A' ' 51' ' ' ARG . 16.5 t70 -49.44 -44.87 45.87 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.866 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -53.19 -42.79 63.22 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.286 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.443 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 14.0 mm100 -72.23 -41.96 66.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.722 0.296 . . . . 0.0 110.333 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.75 -57.37 13.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.159 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.455 ' HD2' ' OD2' ' A' ' 47' ' ' ASP . 12.0 ptm180 -63.64 -45.52 89.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.494 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 31.1 t -65.41 -53.79 37.97 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.846 -176.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.602 ' HG2' ' HG ' ' A' ' 41' ' ' SER . 0.5 OUTLIER -65.77 -35.22 80.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.963 -179.363 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.434 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 59.5 ttp180 -56.07 -46.5 78.96 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.435 0.159 . . . . 0.0 110.928 178.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.11 -52.7 46.22 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 120.998 0.428 . . . . 0.0 110.678 -177.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -55.76 -49.7 72.4 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.17 -45.27 81.51 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.564 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.434 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -50.14 -36.62 30.73 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.286 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -54.94 -41.02 70.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.724 0.297 . . . . 0.0 111.542 175.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -113.08 10.59 18.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.187 0.518 . . . . 0.0 111.376 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.746 ' O ' ' HB2' ' A' ' 117' ' ' GLN . . . -66.55 -60.18 6.97 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-O 119.085 -0.484 . . . . 0.0 111.047 -177.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.726 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 95.9 Cg_endo . . . . . 0 C--N 1.352 0.75 0 C-N-CA 121.876 1.717 . . . . 0.0 111.712 176.362 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.761 0 N-CA-C 113.824 0.289 . . . . 0.0 113.824 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.604 ' HD3' ' OD2' ' A' ' 110' ' ' ASP . 7.8 ttt180 -99.5 113.81 26.41 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 122.894 0.478 . . . . 0.0 109.758 -173.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.423 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 72.9 mmtt -75.64 -26.65 57.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -58.09 -37.16 73.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.168 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.669 HD11 HG12 ' A' ' 98' ' ' ILE . 0.8 OUTLIER -82.97 -22.01 8.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.553 -179.41 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.565 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -47.28 -41.73 19.44 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -172.83 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.581 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 11.9 m-20 -56.44 -31.29 63.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.08 -33.13 50.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.024 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.526 HD22 HD13 ' A' ' 70' ' ' ILE . 26.3 mt -70.55 -45.45 65.42 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.527 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.581 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 14.1 ptpt -68.9 -33.08 73.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.776 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.32 -36.05 80.67 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.954 0.407 . . . . 0.0 110.659 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.655 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -69.92 -48.99 56.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.708 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.466 ' HA ' HD12 ' A' ' 105' ' ' LEU . . . -52.6 -33.96 48.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.503 173.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -65.95 -51.36 59.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.509 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.14 -46.7 82.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.676 177.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -59.43 -33.61 71.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.241 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.46 -38.44 84.21 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.304 0.573 . . . . 0.0 110.823 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 22.7 t -85.72 21.31 1.9 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.322 -177.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 83' ' ' SER . 16.5 m120 73.82 0.43 3.63 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.838 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.641 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 14.8 m-20 -79.07 83.31 5.16 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.687 0.756 . . . . 0.0 110.314 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 58.6 m80 -71.9 -40.59 68.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.28 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.672 ' HA ' HE21 ' A' ' 90' ' ' GLN . 5.3 pt-20 -74.46 -31.52 62.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.26 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.641 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 10.1 mt -58.87 -51.55 69.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.174 0.511 . . . . 0.0 110.204 173.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.548 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -62.41 -44.23 96.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.001 -175.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.672 HE21 ' HA ' ' A' ' 87' ' ' GLU . 26.2 pt20 -66.88 -33.31 75.32 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.729 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.23 -26.24 61.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.855 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 88' ' ' LEU . 51.1 mt -74.15 -55.12 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 177.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.577 ' CG2' HG22 ' A' ' 98' ' ' ILE . 8.8 mm -52.18 -59.18 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.551 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.86 -27.26 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.709 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.78 -20.52 66.43 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.531 -0.758 . . . . 0.0 113.098 -177.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.529 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -84.48 -53.22 5.58 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.136 0.468 . . . . 0.0 110.21 179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.529 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.4 t-20 152.29 -28.29 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -175.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.994 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -57.66 145.38 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 112.44 -2.163 . . . . 0.0 111.734 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.742 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 33.7 p -132.74 165.47 24.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.568 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.86 HD21 ' HD2' ' A' ' 101' ' ' PRO . 2.3 tm? -150.84 113.51 3.16 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 173.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.86 ' HD2' HD21 ' A' ' 100' ' ' LEU . 13.2 Cg_endo -55.68 -42.14 70.47 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 124.012 3.141 . . . . 0.0 114.759 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.601 ' HB3' ' OE1' ' A' ' 35' ' ' GLU . 5.4 m-70 -72.66 -21.25 61.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -176.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . 0.601 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 86.15 17.12 61.55 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.933 -173.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -93.6 143.56 26.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.064 0.459 . . . . 0.0 110.971 -175.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.699 ' HB2' ' HG3' ' A' ' 33' ' ' LYS . 3.0 tm? -78.49 -32.03 48.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.779 -178.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.755 HG23 ' HG3' ' A' ' 37' ' ' PRO . 53.3 p -84.47 16.83 2.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.549 -172.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.601 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 41.1 mt-10 -148.5 140.95 24.28 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 76.8 m -152.19 145.14 24.45 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -118.67 122.8 43.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ASP . . . . . 0.994 ' HA ' HG13 ' A' ' 98' ' ' ILE . 12.6 t70 -80.92 148.41 29.87 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.236 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -57.5 -24.31 55.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.797 -1.092 . . . . 0.0 112.331 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.431 HD12 ' HD2' ' A' ' 67' ' ' ARG . 27.7 mt -79.23 -5.07 53.5 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.928 0.394 . . . . 0.0 110.949 -178.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.43 29.85 6.49 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.154 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.753 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 17.1 m120 -101.52 158.23 16.23 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.91 -0.171 . . . . 0.0 110.764 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -129.45 129.71 44.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.368 0.604 . . . . 0.0 110.762 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . 0.505 ' HE2' ' NE1' ' A' ' 71' ' ' TRP . 17.3 m-85 -117.71 128.44 54.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.869 177.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.746 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 3.8 mm100 -123.21 127.23 48.33 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.485 HD21 HG22 ' A' ' 106' ' ' THR . 36.1 tp -98.75 124.24 46.73 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.385 -171.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.643 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 12.3 Cg_exo -72.82 155.04 53.93 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.33 2.687 . . . . 0.0 112.777 177.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.936 HG12 ' HE1' ' A' ' 39' ' ' TRP . 0.3 OUTLIER -76.45 -20.38 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 114.901 -1.045 . . . . 0.0 112.515 -171.244 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 0.643 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -57.08 -30.09 64.03 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.147 -171.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 46.9 t -94.51 -6.53 43.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.302 -173.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.502 HD12 ' HG3' ' A' ' 37' ' ' PRO . 94.6 mt -118.63 -54.12 2.28 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -175.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -117.67 111.75 39.33 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.154 0.502 . . . . 0.0 111.929 -172.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.37 -39.53 45.94 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 123.745 2.964 . . . . 0.0 115.862 176.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -42.69 -59.12 1.04 Allowed 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.658 2.239 . . . . 0.0 114.507 -175.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.774 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 120.894 0.378 . . . . 0.0 111.746 -176.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.588 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.0 ppt_? . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.238 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.705 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -93.39 156.73 16.61 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 171.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.4 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.9 OUTLIER -81.12 104.21 2.64 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -158.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.903 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 92.5 Cg_endo -78.87 -162.46 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 123.733 2.955 . . . . 0.0 111.839 172.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.542 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.1 mp -49.01 144.68 4.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.308 0.575 . . . . 0.0 112.044 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HD2' ' N ' ' A' ' 33' ' ' LYS . 8.6 mptt -84.85 83.29 8.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.313 -178.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -97.68 -18.33 18.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.936 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.958 ' HB3' ' HB1' ' A' ' 104' ' ' ALA . 9.2 tp10 -87.16 159.73 18.77 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.223 0.535 . . . . 0.0 110.451 -177.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.469 ' HG2' ' OE2' ' A' ' 35' ' ' GLU . 16.6 pttm -99.99 155.13 36.79 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.109 -173.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.692 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 5.1 Cg_exo -73.97 143.28 32.57 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.302 2.001 . . . . 0.0 111.514 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.751 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 23.5 ttpp -110.88 145.69 37.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.225 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 1.038 ' HE1' HG23 ' A' ' 120' ' ' VAL . 0.9 OUTLIER 134.43 -3.68 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 O-C-N 125.227 1.579 . . . . 0.0 109.844 -172.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -113.48 158.73 20.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -167.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.455 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 25.0 m -65.23 125.26 24.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.524 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -61.91 -26.35 68.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.407 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -146.0 88.95 6.19 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.395 173.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.455 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 6.4 Cg_exo -75.4 137.34 20.72 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.924 2.416 . . . . 0.0 111.273 176.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.529 ' HE1' ' HG3' ' A' ' 49' ' ' GLN . 64.1 mtm -114.66 -75.39 0.59 Allowed 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -177.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 78.3 p -115.54 175.68 5.41 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.474 -0.491 . . . . 0.0 111.323 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.01 -41.89 97.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.015 0.436 . . . . 0.0 110.077 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.81 -44.3 87.07 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.697 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.529 ' HG3' ' HE1' ' A' ' 45' ' ' MET . 83.5 mm-40 -68.67 -45.07 72.69 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 176.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -54.92 -47.47 74.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.797 -177.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.0 ptm180 -73.42 -39.44 65.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.604 0.24 . . . . 0.0 111.477 -176.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 m -68.82 -42.18 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.456 ' HA ' ' HD3' ' A' ' 53' ' ' LYS . 60.1 mmtt -71.58 -32.57 68.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.055 177.196 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -53.2 -48.46 68.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.088 0.471 . . . . 0.0 110.041 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.35 -52.58 64.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.99 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.79 -49.34 75.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.722 -1.127 . . . . 0.0 111.734 -177.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.403 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 42.6 m-85 -70.36 -37.16 74.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.744 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.18 -37.56 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 177.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -66.74 -20.29 65.93 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.826 0.346 . . . . 0.0 111.784 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 15.4 m -95.08 -11.87 27.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 109.659 178.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.451 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -86.0 158.23 56.12 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.424 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.451 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 19.3 Cg_endo . . . . . 0 C--N 1.346 0.435 0 C-N-CA 123.016 2.478 . . . . 0.0 113.749 -170.454 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.417 ' HA2' ' CE1' ' A' ' 116' ' ' TYR . . . . . . . . 0 N--CA 1.443 -0.835 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.637 ' O ' HG21 ' A' ' 70' ' ' ILE . 2.7 mmp_? -63.66 80.89 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 171.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.469 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 13.5 tptm -49.62 -37.82 29.5 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.897 0.479 . . . . 0.0 112.119 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.41 -40.74 62.51 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.186 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.637 HG21 ' O ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -84.32 -23.81 7.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.9 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.636 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -53.0 -38.49 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.259 -173.316 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.601 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 18.4 m-20 -62.49 -28.67 69.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.25 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.95 -27.58 39.75 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.519 0.676 . . . . 0.0 109.551 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.714 HD12 ' SG ' ' A' ' 108' ' ' CYS . 27.7 mt -74.71 -43.55 54.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.527 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.1 ptpt -70.53 -29.83 66.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.61 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.42 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.97 -38.29 72.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.767 175.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.442 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -65.64 -44.24 87.03 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.519 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -48.45 -41.14 28.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.694 170.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.42 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 29.7 t60 -62.26 -48.94 77.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.329 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -62.5 -53.03 60.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.622 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.5 ' HD2' HD21 ' A' ' 123' ' ' LEU . 20.6 t80 -55.47 -39.34 70.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.526 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.3 mt-10 -61.1 -33.75 73.87 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 8.1 t -87.57 20.11 3.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.159 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 83' ' ' SER . 3.4 m-20 73.44 4.8 4.89 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.751 0.82 . . . . 0.0 111.599 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.835 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 54.0 m-20 -82.35 84.1 7.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.825 0.821 . . . . 0.0 110.966 -179.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.542 ' NE2' ' HA ' ' A' ' 32' ' ' LEU . 8.0 t-80 -69.03 -42.3 76.56 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.113 177.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.33 -33.75 71.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.146 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.835 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 7.0 mp -65.32 -56.32 13.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.975 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.614 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.67 -41.11 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.508 -176.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -69.35 -30.35 68.36 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.018 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.63 -21.99 51.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.938 0.399 . . . . 0.0 110.762 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 52.9 mt -77.93 -56.84 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.538 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 89' ' ' ALA . 10.1 mm -50.52 -60.67 0.79 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.122 176.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.02 -24.96 66.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.1 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.38 -16.74 73.78 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.859 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -97.99 5.59 48.64 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 122.718 -0.284 . . . . 0.0 110.893 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.6 t30 78.14 0.65 2.71 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.724 0.773 . . . . 0.0 109.76 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.933 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -89.71 144.92 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.426 177.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.588 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 22.7 p -140.62 171.1 14.58 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.456 -177.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.494 HD13 ' H ' ' A' ' 104' ' ' ALA . 1.6 tm? -148.59 103.36 3.46 Favored Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.13 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.448 ' HD2' HD21 ' A' ' 100' ' ' LEU . 21.2 Cg_endo -60.7 -25.13 80.38 Favored 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.763 2.975 . . . . 0.0 114.094 -174.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.405 ' HB2' ' CD1' ' A' ' 100' ' ' LEU . 90.8 m-70 -76.26 -13.08 60.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.889 0.375 . . . . 0.0 110.402 177.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . 0.903 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 77.32 9.18 86.97 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.652 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.958 ' HB1' ' HB3' ' A' ' 35' ' ' GLU . . . -94.47 142.82 26.99 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.65 0.738 . . . . 0.0 111.612 -174.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.5 tm? -78.64 -14.23 59.42 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.225 -1.352 . . . . 0.0 107.792 173.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.692 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 25.4 p -84.24 6.85 21.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.153 -175.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.472 ' HB3' HD22 ' A' ' 100' ' ' LEU . 40.2 mt-10 -145.06 161.1 40.27 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.714 ' SG ' HD12 ' A' ' 74' ' ' LEU . 3.9 p -155.53 133.03 11.06 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.79 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 114' ' ' ASN . 19.4 m-30 -118.75 121.32 39.81 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.568 0.699 . . . . 0.0 109.573 177.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ASP . . . . . 0.933 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -87.29 152.27 22.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.773 -174.334 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.07 -25.47 63.79 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.854 -1.067 . . . . 0.0 112.645 -169.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.9 mt -79.05 -11.53 60.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.553 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.72 31.19 3.75 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.057 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.884 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 43.7 m-80 -96.11 145.09 25.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.689 0.281 . . . . 0.0 111.179 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.462 ' HG3' ' O ' ' A' ' 115' ' ' ARG . 18.6 ptt180 -123.94 128.4 49.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.647 175.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . 0.679 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 35.3 m-85 -128.25 148.04 50.62 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 176.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 62' ' ' PRO . 9.3 mm100 -121.3 120.89 36.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.425 -173.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.699 HD12 ' HD2' ' A' ' 119' ' ' PRO . 13.9 tp -96.57 117.07 66.33 Favored Pre-proline 0 C--N 1.316 -0.868 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.584 -172.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.765 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 35.1 Cg_exo -62.51 154.99 60.87 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.821 3.014 . . . . 0.0 113.744 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 1.038 HG23 ' HE1' ' A' ' 39' ' ' TRP . 3.7 m -68.84 -16.49 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.223 -174.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 0.765 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.1 p90 -61.26 -18.28 57.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -169.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.5 t -121.06 14.54 11.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.059 -176.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.594 ' CD1' HG22 ' A' ' 106' ' ' THR . 95.8 mt -140.77 -52.22 0.47 Allowed 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.898 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.501 ' HB1' ' HB ' ' A' ' 120' ' ' VAL . . . -109.85 156.45 39.85 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.621 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.557 ' CB ' ' HD2' ' A' ' 126' ' ' PRO . 74.1 Cg_exo -53.3 -168.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.269 0 C-N-CA 123.618 2.879 . . . . 0.0 112.158 170.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.557 ' HD2' ' CB ' ' A' ' 125' ' ' PRO . 82.8 Cg_endo -69.74 13.51 0.28 Allowed 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.041 1.827 . . . . 0.0 112.654 -178.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.489 ' H ' ' C ' ' A' ' 125' ' ' PRO . 42.5 mm . . . . . 0 N--CA 1.455 -0.191 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.694 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.9 mmt85 . . . . . 0 CA--C 1.517 -0.303 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.606 ' HB2' ' OD2' ' A' ' 94' ' ' ASP . 3.3 p-10 -89.87 156.84 18.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.498 -175.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -84.52 109.76 22.22 Favored Pre-proline 0 C--N 1.325 -0.5 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -166.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.775 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 88.1 Cg_endo -79.1 -164.92 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.702 2.935 . . . . 0.0 111.467 169.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.04 149.24 19.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.385 0.612 . . . . 0.0 112.114 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.639 ' N ' ' HE2' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -75.69 102.52 5.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.047 -172.436 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -97.29 -20.87 17.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.475 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.573 ' HB2' ' HB2' ' A' ' 104' ' ' ALA . 47.1 mt-10 -103.28 171.86 7.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.03 0.919 . . . . 0.0 113.266 -172.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.605 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 26.7 pttt -106.84 160.29 26.83 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 113.27 -1.786 . . . . 0.0 109.409 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.847 ' HG2' HG12 ' A' ' 120' ' ' VAL . 10.6 Cg_endo -61.58 139.29 80.63 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.266 1.977 . . . . 0.0 112.557 172.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.668 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 2.7 mtmt -112.14 147.81 35.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.198 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.981 ' HE1' HG23 ' A' ' 120' ' ' VAL . 1.9 p-90 132.27 -16.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.616 1.967 . . . . 0.0 108.289 -175.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.744 ' HZ1' HD21 ' A' ' 50' ' ' LEU . 10.1 tppt? -113.45 153.69 28.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.365 -174.12 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.452 ' HG ' ' HG3' ' A' ' 53' ' ' LYS . 48.9 m -65.49 135.02 54.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.265 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -72.08 -27.34 62.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.69 175.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -131.78 81.99 61.67 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.108 170.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.43 130.11 16.83 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.603 2.202 . . . . 0.0 111.053 177.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.516 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.0 mtp -102.1 -87.64 0.4 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -174.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.1 p -118.78 179.09 4.24 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.365 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.517 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.7 t70 -54.66 -48.04 72.82 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.16 -35.15 82.98 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.232 -0.508 . . . . 0.0 112.608 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.686 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 31.3 mm-40 -70.13 -51.55 30.61 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 175.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.744 HD21 ' HZ1' ' A' ' 40' ' ' LYS . 3.2 tm? -55.94 -47.97 76.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.808 -177.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.661 ' HG3' ' N ' ' A' ' 52' ' ' SER . 13.6 ptp180 -62.9 -48.94 76.78 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.235 0.334 . . . . 0.0 111.586 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.661 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 24.3 t -68.46 -47.2 67.75 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -176.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.686 ' HB2' ' O ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -55.11 -44.45 74.99 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.512 173.897 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.422 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 62.0 ttt180 -60.77 -53.04 62.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.305 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.05 -49.93 74.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.77 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -51.97 -49.49 63.13 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.364 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.589 ' CD1' ' HA ' ' A' ' 39' ' ' TRP . 3.6 t80 -75.25 -38.91 60.3 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.581 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.503 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -53.99 -33.47 57.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.755 0.312 . . . . 0.0 111.338 -179.727 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.48 -25.85 68.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 0.0 111.566 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -109.13 -30.45 8.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.807 -172.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.64 ' HB1' ' HD3' ' A' ' 62' ' ' PRO . . . -49.49 -56.92 13.7 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -174.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.64 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 43.5 Cg_endo . . . . . 0 N--CA 1.458 -0.597 0 C-N-CA 122.19 1.927 . . . . 0.0 113.042 -177.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.713 ' HA2' ' HB3' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.442 -0.909 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.522 ' H ' ' HE2' ' A' ' 116' ' ' TYR . 7.3 ttt85 -159.85 133.41 7.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.85 0.357 . . . . 0.0 110.185 -175.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 71' ' ' TRP . 75.4 mmtt -77.66 -25.64 49.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.12 -175.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -57.9 -52.91 63.56 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.315 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.58 HD11 HG12 ' A' ' 98' ' ' ILE . 0.1 OUTLIER -68.37 -23.13 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.71 -178.499 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.531 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 1.8 m95 -50.99 -34.33 28.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 111.481 -178.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.745 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 17.2 t70 -56.89 -39.87 75.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.829 177.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.74 -27.08 60.99 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.227 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.676 HD12 ' SG ' ' A' ' 108' ' ' CYS . 24.6 mt -68.92 -43.65 74.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 72' ' ' ASP . 8.4 mtmt -64.95 -46.3 82.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -57.74 -43.93 85.71 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.669 178.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.717 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -68.01 -52.31 37.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.725 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.499 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -50.0 -35.28 24.0 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 123.451 0.469 . . . . 0.0 110.462 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.488 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 21.4 t60 -60.68 -52.24 65.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.28 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.549 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -67.68 -52.53 36.84 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.705 177.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -51.31 -36.12 41.12 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.782 178.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -57.49 -39.22 75.99 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.183 0.516 . . . . 0.0 111.138 175.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.5 t -87.63 23.72 1.89 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.214 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 71.89 5.2 5.28 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.072 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.549 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 8.8 t0 -79.58 89.63 5.1 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.491 0.662 . . . . 0.0 110.418 -178.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 56.8 m80 -70.74 -35.82 72.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.008 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.519 ' HA ' HE21 ' A' ' 90' ' ' GLN . 9.4 pt-20 -70.22 -44.39 68.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.833 -170.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.449 ' O ' HG13 ' A' ' 92' ' ' ILE . 13.3 mt -60.65 -54.42 45.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.819 0.342 . . . . 0.0 111.316 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.488 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.71 -42.87 94.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.908 -174.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.519 HE21 ' HA ' ' A' ' 87' ' ' GLU . 25.8 pt20 -70.57 -32.89 70.46 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.68 -24.21 49.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 88' ' ' LEU . 41.2 mt -72.26 -57.7 6.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.391 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.516 ' CG2' HG22 ' A' ' 98' ' ' ILE . 9.6 mm -50.0 -57.49 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.839 174.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . 0.606 ' OD2' ' HB2' ' A' ' 29' ' ' ASN . 3.9 t70 -64.4 -31.53 72.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.852 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -74.36 -10.21 81.88 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.391 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.5 -0.68 51.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.681 -0.305 . . . . 0.0 110.415 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 74.73 7.86 4.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 122.024 0.916 . . . . 0.0 109.071 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.939 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -87.38 137.09 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 114.455 -1.248 . . . . 0.0 108.74 172.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.694 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 40.1 p -120.37 166.09 14.01 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.218 -175.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.561 HD21 ' HD2' ' A' ' 101' ' ' PRO . 1.6 tm? -149.47 101.44 3.3 Favored Pre-proline 0 N--CA 1.446 -0.658 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.666 176.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.561 ' HD2' HD21 ' A' ' 100' ' ' LEU . 26.4 Cg_endo -61.39 -16.79 49.43 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.801 3.001 . . . . 0.0 113.871 -172.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.529 ' HB2' ' CD1' ' A' ' 100' ' ' LEU . 56.3 m-70 -82.83 -18.69 39.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.06 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . 0.775 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 80.01 9.98 86.08 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.98 -0.628 . . . . 0.0 112.386 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.573 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . . . -98.84 148.2 24.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.259 0.552 . . . . 0.0 111.776 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.717 HD22 ' HB1' ' A' ' 77' ' ' ALA . 2.6 tm? -79.15 -17.67 54.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 174.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.904 HG22 HD11 ' A' ' 123' ' ' LEU . 52.4 p -87.57 21.18 2.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.019 -171.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.541 ' HB3' HD22 ' A' ' 100' ' ' LEU . 49.1 mt-10 -157.12 160.37 38.77 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.677 ' SG ' ' HB2' ' A' ' 116' ' ' TYR . 13.3 p -154.8 139.37 16.92 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.318 174.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.452 ' HD1' ' O ' ' A' ' 108' ' ' CYS . 11.8 m-30 -118.52 120.86 38.78 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ASP . . . . . 0.972 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 5.0 t70 -80.69 145.23 31.7 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.674 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -60.01 -22.28 62.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.868 -170.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.18 28.65 4.31 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.311 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.972 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 60.7 m-80 -98.97 158.65 15.51 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.984 -0.127 . . . . 0.0 110.796 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -139.34 139.65 37.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.331 . . . . 0.0 111.467 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . 0.677 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 27.6 m-85 -136.67 152.75 50.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.113 175.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.468 ' O ' ' HD3' ' A' ' 119' ' ' PRO . 10.2 mm100 -122.05 120.83 35.49 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.624 ' HB2' ' C ' ' A' ' 106' ' ' THR . 4.1 mm? -90.06 109.79 35.55 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-O 121.143 0.497 . . . . 0.0 111.512 -176.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.542 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 22.1 Cg_exo -74.74 156.09 44.18 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 124.152 3.235 . . . . 0.0 113.633 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.981 HG23 ' HE1' ' A' ' 39' ' ' TRP . 4.9 m -63.63 -16.68 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.735 -1.12 . . . . 0.0 113.178 -173.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 0.542 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.2 p90 -58.35 -23.54 57.14 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -169.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 39.4 t -129.84 27.35 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.096 0.474 . . . . 0.0 109.877 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.904 HD11 HG22 ' A' ' 106' ' ' THR . 95.1 mt -138.27 -50.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.917 -176.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -135.08 111.5 11.03 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 120.962 0.41 . . . . 0.0 111.833 -175.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.653 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 31.6 Cg_exo -61.51 -43.57 26.8 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.545 2.83 . . . . 0.0 115.271 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 16.3 Cg_exo -29.68 -56.87 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 124.866 3.711 . . . . 0.0 115.63 -174.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.85 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.402 0 CA-C-O 121.111 0.481 . . . . 0.0 111.853 -176.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 C--O 1.233 0.214 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.529 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 31.0 p-10 -99.31 159.61 14.88 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.851 -172.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.589 ' HG2' ' HZ3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -84.37 110.27 25.52 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.229 -165.149 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.552 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.6 Cg_exo -70.75 -162.91 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 124.056 3.171 . . . . 0.0 112.666 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.632 HD13 ' H ' ' A' ' 32' ' ' LEU . 6.5 mp -41.52 139.25 1.15 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.408 0.683 . . . . 0.0 112.798 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.962 ' HE2' ' HG2' ' A' ' 90' ' ' GLN . 2.3 mptp? -89.8 74.45 7.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.629 -176.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.92 -15.4 19.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.446 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -77.03 156.91 31.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.491 0.662 . . . . 0.0 111.008 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.5 pttt -94.97 159.23 33.57 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.038 -172.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.504 ' HB2' ' CG1' ' A' ' 120' ' ' VAL . 12.2 Cg_exo -68.86 144.83 60.34 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.055 1.837 . . . . 0.0 111.296 174.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.764 ' HZ2' ' NE2' ' A' ' 117' ' ' GLN . 31.9 ttpt -111.04 145.19 38.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.303 -170.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 1.01 ' HE1' HG23 ' A' ' 120' ' ' VAL . 1.0 OUTLIER 134.75 -9.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 O-C-N 125.429 1.706 . . . . 0.0 109.775 -179.348 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.777 ' HG2' HG11 ' A' ' 120' ' ' VAL . 0.0 OUTLIER -113.61 168.89 9.38 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.386 0.612 . . . . 0.0 111.396 -171.049 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.404 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 19.2 m -85.82 133.13 33.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.287 -176.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.3 -27.85 66.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.444 0.64 . . . . 0.0 109.338 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -141.43 84.4 12.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.892 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 16.3 Cg_exo -68.49 144.36 60.83 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.825 2.35 . . . . 0.0 111.805 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.445 ' HB3' ' H ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -127.21 -135.25 0.24 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.279 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.445 ' H ' ' HB3' ' A' ' 45' ' ' MET . 69.0 p -73.1 170.05 15.73 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -171.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 20.4 t70 -55.15 -37.88 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.617 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.44 -36.59 63.97 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.109 177.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -75.42 -39.16 59.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.8 tp -58.66 -53.18 61.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.903 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 16.4 ptp180 -60.72 -46.83 88.9 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.082 -178.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 18.2 m -65.2 -47.66 76.14 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.947 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.601 ' C ' ' HD2' ' A' ' 53' ' ' LYS . 4.5 tmmm? -56.95 -45.75 82.59 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.135 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -53.5 -53.47 50.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.429 -174.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.1 -50.4 48.48 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.051 0.453 . . . . 0.0 111.147 -177.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.473 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 1.7 tm-20 -54.56 -49.87 69.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.836 -177.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.401 ' CE1' ' HG2' ' A' ' 53' ' ' LYS . 12.1 m-85 -71.48 -39.05 71.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.622 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.488 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 1.9 m95 -56.91 -23.08 42.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . 0.473 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 7.5 t70 -65.9 -37.24 85.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.858 0.361 . . . . 0.0 111.351 173.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.2 m -107.91 -22.08 12.58 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -169.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.584 ' HB1' ' HD3' ' A' ' 62' ' ' PRO . . . -60.46 -59.19 14.63 Favored Pre-proline 0 CA--C 1.538 0.512 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.584 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 88.0 Cg_endo . . . . . 0 C--N 1.349 0.56 0 C-N-CA 122.073 1.849 . . . . 0.0 112.953 -174.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.437 ' HA3' ' CZ ' ' A' ' 116' ' ' TYR . . . . . . . . 0 N--CA 1.44 -1.073 0 N-CA-C 111.421 -0.672 . . . . 0.0 111.421 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.534 ' O ' HG23 ' A' ' 70' ' ' ILE . 68.6 mmt-85 -102.9 116.69 33.03 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.409 ' HD2' ' OE1' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -77.63 -15.92 58.88 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.776 0.322 . . . . 0.0 110.807 -177.668 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.409 ' OE1' ' HD2' ' A' ' 68' ' ' LYS . 6.8 mp0 -60.57 -41.98 95.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.244 175.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.565 HD13 HD22 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -82.98 -19.84 9.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.36 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.521 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -46.57 -41.42 14.41 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 122.569 0.348 . . . . 0.0 111.891 -176.241 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.528 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 10.4 m-20 -59.8 -32.63 70.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.18 -35.15 66.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.09 0.471 . . . . 0.0 109.919 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.565 HD22 HD13 ' A' ' 70' ' ' ILE . 25.4 mt -66.22 -48.65 69.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.594 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.528 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 14.3 ptpt -68.78 -28.03 66.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.855 179.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.2 -36.9 66.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.916 0.388 . . . . 0.0 110.672 176.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.473 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -68.67 -48.0 65.06 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.475 176.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.471 ' HA ' HD12 ' A' ' 105' ' ' LEU . . . -52.76 -34.3 52.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.826 172.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -64.4 -51.9 60.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.948 0.404 . . . . 0.0 109.929 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.404 ' HB1' ' HB2' ' A' ' 88' ' ' LEU . . . -64.1 -55.56 21.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.187 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -52.68 -34.81 53.64 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.642 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.012 0.434 . . . . 0.0 111.395 176.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 7.1 t -85.31 15.55 4.27 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.447 ' HB2' ' O ' ' A' ' 83' ' ' SER . 36.3 m-80 73.6 5.18 4.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.589 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.21 84.62 3.68 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.859 0.837 . . . . 0.0 110.584 176.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.449 ' NE2' ' HA ' ' A' ' 32' ' ' LEU . 12.6 t-80 -70.36 -39.59 74.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.256 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -60.28 -44.0 95.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.387 -178.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.443 ' O ' HG13 ' A' ' 92' ' ' ILE . 12.7 mt -63.71 -51.48 64.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.736 -177.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.58 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -60.55 -39.29 87.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.605 -175.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.962 ' HG2' ' HE2' ' A' ' 33' ' ' LYS . 9.2 mt-30 -65.46 -43.67 89.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.705 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -21.17 64.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.029 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.4 mt -82.12 -60.94 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.505 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.582 HG23 HG22 ' A' ' 98' ' ' ILE . 9.3 mm -55.23 -54.34 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.829 0.347 . . . . 0.0 111.253 178.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.48 -33.19 75.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.273 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -69.97 -14.44 70.72 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.225 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -95.99 3.72 53.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 84.5 m-20 75.89 7.6 3.69 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.688 0.617 . . . . 0.0 109.621 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.899 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -89.94 139.47 17.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.036 -0.984 . . . . 0.0 109.831 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 p -124.26 162.74 23.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.222 0.535 . . . . 0.0 111.619 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.631 HD21 ' HD2' ' A' ' 101' ' ' PRO . 1.7 tm? -150.1 109.83 3.25 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.463 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.631 ' HD2' HD21 ' A' ' 100' ' ' LEU . 38.0 Cg_endo -64.71 -24.01 62.61 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.185 2.59 . . . . 0.0 113.655 -172.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.526 ' HB2' ' CD1' ' A' ' 100' ' ' LEU . 11.3 m170 -76.29 -18.75 58.81 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.784 0.325 . . . . 0.0 111.283 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . 0.552 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 80.51 11.68 83.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.702 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -93.29 152.02 19.43 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.297 0.57 . . . . 0.0 111.56 -173.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.845 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 2.8 tm? -84.89 -23.36 28.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.209 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.451 HG23 ' HG3' ' A' ' 37' ' ' PRO . 47.0 p -88.46 17.62 5.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.53 -174.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 66.4 mt-10 -150.5 143.21 24.57 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 81.8 m -152.01 139.24 19.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.886 0.374 . . . . 0.0 111.519 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.542 ' HE1' ' HG3' ' A' ' 115' ' ' ARG . 19.7 m-30 -118.94 122.02 41.27 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.469 0.652 . . . . 0.0 109.46 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ASP . . . . . 0.952 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.9 t70 -83.32 145.42 29.08 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.009 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.89 -27.49 60.68 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 124.451 1.095 . . . . 0.0 112.271 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.0 mt -76.47 -11.91 59.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.453 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.66 30.22 3.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.253 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.952 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 57.3 m-80 -98.76 157.92 15.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.744 0.307 . . . . 0.0 110.952 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.542 ' HG3' ' HE1' ' A' ' 109' ' ' TYR . 11.4 ttm180 -134.53 122.53 22.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 -174.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . 0.437 ' CZ ' ' HA3' ' A' ' 66' ' ' GLY . 38.5 m-85 -120.85 124.8 45.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.375 175.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.764 ' NE2' ' HZ2' ' A' ' 38' ' ' LYS . 4.0 mm100 -122.34 121.37 36.55 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.474 HD23 HD11 ' A' ' 123' ' ' LEU . 21.5 tp -98.65 122.2 53.98 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -166.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.574 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 11.2 Cg_exo -74.84 157.38 43.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.974 3.116 . . . . 0.0 113.215 177.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 1.01 HG23 ' HE1' ' A' ' 39' ' ' TRP . 20.4 m -72.58 -10.03 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.798 -175.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 0.574 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.1 p90 -56.24 -24.11 40.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -170.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 52.2 t -113.4 3.53 15.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.74 0.305 . . . . 0.0 111.111 -176.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.474 HD11 HD23 ' A' ' 118' ' ' LEU . 20.0 mt -125.47 -53.61 1.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.848 0.356 . . . . 0.0 111.842 -174.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.608 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -136.15 111.59 10.13 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.691 0.281 . . . . 0.0 110.764 -176.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.49 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 11.1 Cg_endo -92.78 6.7 3.07 Favored 'Trans proline' 0 CA--C 1.559 1.764 0 C-N-CA 123.281 2.654 . . . . 0.0 117.379 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.608 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 17.4 Cg_endo -59.29 -31.57 95.32 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 122.921 2.079 . . . . 0.0 111.776 174.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.652 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.091 178.642 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.47 ' H ' ' HG3' ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 121.039 0.447 . . . . 0.0 111.231 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.493 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -101.08 157.96 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.349 176.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.789 ' HB3' ' HA2' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -87.19 117.67 68.92 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -168.829 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.774 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 13.4 Cg_exo -72.17 -163.4 0.14 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.227 2.618 . . . . 0.0 111.476 164.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.447 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.2 mp -59.99 142.86 53.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.808 0.337 . . . . 0.0 110.985 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.538 ' HE3' ' HB2' ' A' ' 86' ' ' HIS . 0.0 OUTLIER -78.02 71.98 4.52 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.274 0.559 . . . . 0.0 111.586 -178.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -87.29 -17.3 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.547 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.27 169.56 17.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.528 0.68 . . . . 0.0 111.729 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -108.62 149.72 39.8 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.215 -176.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.647 ' HG3' HG23 ' A' ' 106' ' ' THR . 22.9 Cg_exo -60.8 138.75 81.35 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.566 2.177 . . . . 0.0 111.665 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.45 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 3.4 tmmm? -111.17 122.47 47.96 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.891 0.853 . . . . 0.0 112.761 -170.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 1.055 ' HE1' HG23 ' A' ' 120' ' ' VAL . 1.9 p-90 175.04 23.26 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 113.058 -1.883 . . . . 0.0 108.159 172.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.576 ' HE2' HG12 ' A' ' 127' ' ' ILE . 1.8 tmmt? -142.24 149.55 39.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.444 -156.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.479 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 57.7 m -66.75 119.64 12.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.373 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -64.54 -25.56 68.04 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -130.16 83.6 62.66 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.592 171.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -70.03 141.38 43.96 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.636 2.224 . . . . 0.0 112.35 -178.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -116.75 -135.63 0.35 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 37.3 p -72.93 -179.88 3.4 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -65.68 -37.19 85.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.737 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.8 -38.82 96.71 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.026 -0.607 . . . . 0.0 111.633 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.839 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -71.68 -33.55 68.93 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.612 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.681 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 3.2 tm? -60.49 -52.7 64.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.322 178.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 52' ' ' SER . 6.6 ptm180 -65.1 -54.9 22.78 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -176.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.476 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 47.7 m -62.75 -50.9 69.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.421 -174.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.471 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 0.1 OUTLIER -67.94 -28.37 67.41 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.903 -177.718 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.681 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.2 -39.48 94.75 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.801 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.82 -48.32 66.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.243 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.03 -52.41 43.32 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.471 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 17.8 m-85 -59.97 -40.04 87.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.531 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -25.0 61.41 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -73.72 -32.47 63.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.115 0.483 . . . . 0.0 110.859 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 m -92.32 -23.43 19.26 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.324 -174.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.715 ' HB1' ' HD3' ' A' ' 62' ' ' PRO . . . -59.98 -67.02 1.15 Allowed Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.715 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 88.8 Cg_endo . . . . . 0 C--N 1.351 0.683 0 C-N-CA 121.52 1.48 . . . . 0.0 112.462 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . 0.474 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.794 0 N-CA-C 112.786 -0.126 . . . . 0.0 112.786 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.674 ' HB3' HG21 ' A' ' 70' ' ' ILE . 7.7 tpt180 -81.12 112.75 18.77 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.56 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 14.3 tptm -61.57 -33.02 73.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.915 0.388 . . . . 0.0 110.584 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.72 -45.18 82.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.62 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.674 HG21 ' HB3' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -77.27 -21.18 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.198 -177.507 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.56 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.32 -42.92 22.23 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.28 0.562 . . . . 0.0 111.208 -176.563 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . 0.558 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 7.9 m-20 -66.04 -25.57 67.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.894 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.6 -29.78 46.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.4 0.619 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.46 HD22 HD13 ' A' ' 70' ' ' ILE . 17.2 mt -70.19 -51.2 32.92 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.506 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 13.2 ptpt -64.89 -32.74 74.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.867 178.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.416 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.26 -35.57 73.88 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.752 0.311 . . . . 0.0 110.945 176.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.55 ' HB1' ' HB3' ' A' ' 89' ' ' ALA . . . -68.87 -46.91 67.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.484 176.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.549 ' HB3' HD22 ' A' ' 123' ' ' LEU . . . -52.59 -36.02 55.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.419 173.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.519 ' O ' ' HB2' ' A' ' 82' ' ' GLU . 63.6 t60 -62.98 -47.09 84.65 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.342 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.06 -51.32 59.26 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.56 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.528 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 1.8 t80 -54.04 -34.7 60.72 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.891 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.539 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 28.6 mt-10 -51.37 -48.72 62.43 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 175.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . 0.541 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 15.2 m -76.41 -19.69 57.85 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.731 -173.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . 0.541 ' HB2' ' O ' ' A' ' 83' ' ' SER . 9.7 t30 138.93 -17.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.226 0 O-C-N 124.947 1.405 . . . . 0.0 109.846 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.542 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 0.2 OUTLIER -71.73 90.63 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -165.106 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.692 ' O ' ' HG2' ' A' ' 90' ' ' GLN . 27.4 t-80 -70.45 -44.99 66.66 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.011 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 87' ' ' GLU . 1.7 pm0 -62.96 -47.03 84.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.73 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.524 ' O ' HG13 ' A' ' 92' ' ' ILE . 4.2 mt -54.45 -56.36 19.52 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.251 0.548 . . . . 0.0 110.838 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.743 ' HB3' HD21 ' A' ' 105' ' ' LEU . . . -61.31 -42.64 99.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.766 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.692 ' HG2' ' O ' ' A' ' 86' ' ' HIS . 22.6 mm-40 -63.74 -38.45 91.14 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.171 -0.211 . . . . 0.0 111.18 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.77 -30.77 69.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.906 0.384 . . . . 0.0 110.284 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 88' ' ' LEU . 57.2 mt -69.71 -59.97 2.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.851 178.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.575 ' CG2' HG22 ' A' ' 98' ' ' ILE . 8.5 mm -52.4 -57.17 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.134 0.492 . . . . 0.0 111.005 178.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -64.56 -24.49 67.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.042 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.57 -19.2 68.78 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.697 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -101.53 4.24 40.89 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.692 -0.299 . . . . 0.0 110.603 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 3.7 m-20 72.9 8.11 5.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.565 0.698 . . . . 0.0 110.107 -174.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.984 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.6 mp -82.05 136.92 22.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.82 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.538 ' HA ' ' OE1' ' A' ' 30' ' ' GLN . 25.6 p -138.61 171.18 14.73 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.409 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 107' ' ' GLU . 1.5 tm? -148.52 114.33 3.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.565 ' HD2' HD21 ' A' ' 100' ' ' LEU . 34.7 Cg_endo -65.13 -17.62 59.32 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.492 2.795 . . . . 0.0 114.558 -174.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.577 ' HB2' ' CD1' ' A' ' 100' ' ' LEU . 18.8 m-70 -79.93 -23.22 41.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.179 0.514 . . . . 0.0 111.033 177.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . 0.789 ' HA2' ' HB3' ' A' ' 30' ' ' GLN . . . 75.99 17.29 80.12 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.392 -0.909 . . . . 0.0 111.567 -172.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -94.96 141.38 28.72 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 121.168 0.509 . . . . 0.0 110.406 -176.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.743 HD21 ' HB3' ' A' ' 89' ' ' ALA . 0.3 OUTLIER -75.29 -21.63 58.34 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.9 -1.046 . . . . 0.0 109.005 179.122 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.647 HG23 ' HG3' ' A' ' 37' ' ' PRO . 64.4 p -90.71 15.05 11.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.936 -173.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.583 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.4 mt-10 -148.55 143.87 26.91 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 175.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.8 m -150.75 139.17 20.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.524 0.202 . . . . 0.0 110.523 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -118.92 123.16 43.96 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.343 0.592 . . . . 0.0 109.967 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ASP . . . . . 0.984 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.3 t70 -87.11 147.22 25.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.503 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.55 -24.71 57.63 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.112 -172.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 27.4 mt -76.71 -3.04 35.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 110.938 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.11 34.39 6.48 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 0.772 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 11.6 m120 -106.6 157.88 17.35 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -139.95 139.16 36.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.229 0.537 . . . . 0.0 110.942 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . 0.426 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 40.1 m-85 -124.91 127.75 47.57 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.921 175.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -121.38 122.52 40.01 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -176.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.488 HD21 HD13 ' A' ' 123' ' ' LEU . 30.8 tp -102.53 123.29 43.28 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.065 -167.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.653 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 20.4 Cg_exo -69.48 155.76 65.94 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.737 2.958 . . . . 0.0 112.751 176.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 1.055 HG23 ' HE1' ' A' ' 39' ' ' TRP . 20.2 m -66.17 -17.71 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.656 -175.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 0.653 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.3 p90 -60.65 -22.14 63.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -166.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.7 t -110.59 1.48 18.1 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.601 -174.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.549 HD22 ' HB3' ' A' ' 78' ' ' ALA . 90.3 mt -130.31 -37.02 1.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 0.0 111.808 -177.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -117.46 112.53 39.19 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.439 -175.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.538 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 51.3 Cg_exo -56.38 -34.91 95.51 Favored 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.648 2.899 . . . . 0.0 115.674 177.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 48.8 Cg_endo -67.31 -149.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.365 1.444 0 C-N-CA 121.778 1.652 . . . . 0.0 112.459 175.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.576 HG12 ' HE2' ' A' ' 40' ' ' LYS . 4.0 mp . . . . . 0 C--O 1.232 0.146 0 CA-C-O 122.383 1.087 . . . . 0.0 109.759 -174.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . 0.618 ' O ' ' HB ' ' A' ' 99' ' ' THR . 10.8 mtm180 . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 121.036 0.446 . . . . 0.0 110.751 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.453 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 26.1 p-10 -91.1 156.75 17.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.621 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . 0.857 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 3.7 pm0 -88.78 118.16 69.03 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 121.787 0.804 . . . . 0.0 112.219 -170.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.629 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 5.2 Cg_exo -77.4 -164.38 0.26 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.493 2.795 . . . . 0.0 111.435 169.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LEU . . . . . 0.543 ' HG ' ' NE2' ' A' ' 86' ' ' HIS . 7.7 tt -40.82 120.71 1.35 Allowed 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 173.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LYS . . . . . 0.725 ' HB3' ' H ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -56.83 121.75 10.6 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 121.473 0.654 . . . . 0.0 111.655 -177.426 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -95.2 -33.92 12.43 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.395 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.14 170.1 12.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.516 174.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -110.53 162.37 20.83 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.56 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PRO . . . . . 0.46 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 22.0 Cg_exo -59.98 123.26 12.83 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.625 1.55 . . . . 0.0 110.839 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.639 ' HZ1' ' NE2' ' A' ' 117' ' ' GLN . 3.4 tmmm? -108.09 122.14 46.28 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.891 0.853 . . . . 0.0 112.207 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' TRP . . . . . 0.955 ' HE1' HG23 ' A' ' 120' ' ' VAL . 2.5 p-90 171.08 24.27 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.795 -2.002 . . . . 0.0 107.882 177.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.573 ' HD2' ' N ' ' A' ' 41' ' ' SER . 1.2 tmmt? -141.13 152.88 45.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.298 -153.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . 0.573 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 48.2 m -64.62 127.29 30.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.447 -177.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -61.72 -29.54 70.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.86 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -147.56 95.95 4.21 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.693 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.52 129.02 13.24 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.667 2.244 . . . . 0.0 111.866 176.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' MET . . . . . 0.608 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.6 mtp -94.27 -85.27 0.3 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.057 -179.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.0 p -114.85 -178.16 3.3 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.423 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . 0.493 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 9.0 p-10 -69.22 -33.36 73.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.81 0.338 . . . . 0.0 110.336 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.71 -38.05 95.62 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.619 176.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 0.608 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 15.7 mm100 -70.94 -41.54 71.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.856 0.36 . . . . 0.0 110.181 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.74 -50.42 73.27 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.455 -179.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.493 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 7.2 ptm180 -66.51 -42.41 87.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.7 t -65.61 -52.08 54.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.924 0.392 . . . . 0.0 110.286 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.433 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 3.4 tppt? -63.1 -35.28 79.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.431 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -56.81 -46.94 81.29 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.902 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.48 -46.11 73.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.003 0.43 . . . . 0.0 110.86 -177.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -53.44 -49.57 67.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.799 175.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.428 ' CE2' ' HG3' ' A' ' 53' ' ' LYS . 19.0 m-85 -63.22 -43.91 96.76 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.1 176.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' TRP . . . . . 0.436 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 0.1 OUTLIER -49.6 -36.06 22.89 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 178.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -70.16 -26.12 63.77 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.6 m -96.12 -24.31 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.757 0.789 . . . . 0.0 109.821 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.528 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -68.32 159.18 82.02 Favored Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.405 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.528 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 21.4 Cg_endo . . . . . 0 N--CA 1.46 -0.45 0 C-N-CA 122.99 2.46 . . . . 0.0 112.713 -173.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.848 0 N-CA-C 111.576 -0.61 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.492 ' O ' HG23 ' A' ' 70' ' ' ILE . 37.7 mtt180 -65.89 109.75 2.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.962 0.41 . . . . 0.0 110.266 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.743 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 72.9 mmtt -64.84 -23.41 67.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.681 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLU . . . . . 0.423 ' H ' ' HG3' ' A' ' 69' ' ' GLU . 22.6 mt-10 -52.51 -53.63 43.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.031 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.606 HG13 ' CD1' ' A' ' 98' ' ' ILE . 0.0 OUTLIER -82.84 -25.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.668 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' TRP . . . . . 0.743 ' HB2' ' HA ' ' A' ' 68' ' ' LYS . 5.9 m95 -52.41 -35.95 53.14 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.053 177.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -55.68 -39.35 70.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.426 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.35 -28.76 37.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 110.382 -175.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.492 HD22 ' CD1' ' A' ' 70' ' ' ILE . 21.8 mt -64.65 -49.87 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.25 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.628 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 10.7 ptpt -73.43 -26.68 61.05 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.093 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -67.33 -41.11 85.77 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.895 0.379 . . . . 0.0 110.636 175.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ALA . . . . . 0.584 ' HB1' ' HB3' ' A' ' 89' ' ' ALA . . . -66.94 -50.93 60.82 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.206 176.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ALA . . . . . 0.587 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -51.29 -32.89 26.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.733 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' HIS . . . . . 0.471 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 65.5 t60 -62.56 -50.67 70.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.894 0.378 . . . . 0.0 110.468 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.08 -52.06 52.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.559 177.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.484 ' CE1' ' HD2' ' A' ' 33' ' ' LYS . 10.4 t80 -55.68 -26.79 46.65 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.32 178.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.587 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.0 mt-10 -57.22 -34.56 68.68 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.671 -0.643 . . . . 0.0 110.785 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.5 t -90.77 16.62 8.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.461 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.8 t30 70.68 8.52 6.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.397 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.589 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 11.0 t0 -76.07 93.37 3.3 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.784 -177.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' HIS . . . . . 0.638 ' O ' ' HG3' ' A' ' 90' ' ' GLN . 66.2 m80 -71.37 -50.79 28.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.777 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -58.61 -40.65 83.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.191 -171.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.532 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.8 mt -59.01 -52.48 65.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.89 0.376 . . . . 0.0 110.812 176.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.873 ' HB3' HD21 ' A' ' 105' ' ' LEU . . . -65.59 -40.02 92.22 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.467 -175.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLN . . . . . 0.638 ' HG3' ' O ' ' A' ' 86' ' ' HIS . 19.9 mt-30 -58.08 -46.59 85.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.468 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.15 -25.08 60.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.724 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 88' ' ' LEU . 46.4 mt -69.91 -59.43 3.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.641 0.258 . . . . 0.0 110.628 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ILE . . . . . 0.574 ' CG2' HG22 ' A' ' 98' ' ' ILE . 10.6 mm -53.04 -59.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.301 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -63.93 -25.26 68.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.364 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.97 56.11 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.622 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . 0.692 ' HB1' HD11 ' A' ' 98' ' ' ILE . . . -112.41 15.89 20.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 122.548 -0.384 . . . . 0.0 111.574 -179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 83.5 m-20 72.2 9.72 5.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 122.041 0.924 . . . . 0.0 108.948 -177.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ILE . . . . . 0.692 HD11 ' HB1' ' A' ' 96' ' ' ALA . 50.3 mt -96.25 138.03 22.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.594 -176.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' THR . . . . . 0.618 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 34.3 p -139.13 168.66 19.34 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.227 -0.589 . . . . 0.0 112.178 -170.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' LEU . . . . . 0.857 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 2.7 tm? -149.38 99.62 3.39 Favored Pre-proline 0 N--CA 1.452 -0.354 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.086 174.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' PRO . . . . . 0.414 ' HD2' HD21 ' A' ' 100' ' ' LEU . 56.0 Cg_endo -66.68 -10.72 29.07 Favored 'Trans proline' 0 N--CA 1.475 0.383 0 C-N-CA 123.433 2.756 . . . . 0.0 113.29 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' HIS . . . . . 0.67 ' HB2' HD11 ' A' ' 100' ' ' LEU . 48.8 m170 -84.02 -9.85 58.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.702 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLY . . . . . 0.629 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 67.84 38.15 89.03 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.623 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ALA . . . . . 0.73 ' H ' HD13 ' A' ' 100' ' ' LEU . . . -122.67 139.39 54.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.287 0.565 . . . . 0.0 111.391 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.873 HD21 ' HB3' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -76.9 -22.08 53.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.043 -0.98 . . . . 0.0 108.412 176.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.531 HG22 HD12 ' A' ' 123' ' ' LEU . 59.1 p -91.84 18.11 8.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.606 -172.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.7 mt-10 -150.62 149.14 29.49 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 171.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . 0.422 ' SG ' HD21 ' A' ' 74' ' ' LEU . 80.6 m -150.55 144.09 25.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.798 0.332 . . . . 0.0 110.416 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . 0.641 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 18.0 m-30 -118.48 121.73 40.99 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.093 0.473 . . . . 0.0 109.835 177.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ASP . . . . . 1.035 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.3 t70 -79.78 145.18 32.98 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.597 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -59.6 -24.47 63.82 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.967 -168.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 mt -76.82 -13.73 59.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.118 0.485 . . . . 0.0 110.495 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.23 28.05 3.2 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.452 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASN . . . . . 1.035 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 51.5 m-80 -94.1 143.01 26.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.794 0.297 . . . . 0.0 110.766 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.641 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 53.2 ttp180 -123.3 121.19 35.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -127.16 140.7 52.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.942 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' GLN . . . . . 0.639 ' NE2' ' HZ1' ' A' ' 38' ' ' LYS . 25.8 mt-30 -123.11 146.36 47.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' LEU . . . . . 0.614 HD12 ' HD2' ' A' ' 119' ' ' PRO . 15.8 tp -111.96 121.98 38.15 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -167.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' PRO . . . . . 0.614 ' HD2' HD12 ' A' ' 118' ' ' LEU . 14.5 Cg_exo -72.13 157.49 54.01 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.847 3.031 . . . . 0.0 113.372 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' VAL . . . . . 0.955 HG23 ' HE1' ' A' ' 39' ' ' TRP . 9.3 m -69.62 -14.41 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.385 -175.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' TYR . . . . . 0.597 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -56.46 -22.3 31.28 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -168.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 40.7 t -124.75 16.41 8.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.818 0.342 . . . . 0.0 110.919 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' LEU . . . . . 0.531 HD12 HG22 ' A' ' 106' ' ' THR . 72.7 mt -131.63 -54.34 1.01 Allowed 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.138 -0.351 . . . . 0.0 111.705 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' ALA . . . . . 0.512 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -129.98 111.74 17.17 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.828 0.346 . . . . 0.0 110.583 -175.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' PRO . . . . . 0.424 ' N ' ' CD ' ' A' ' 126' ' ' PRO . 89.8 Cg_endo -87.54 -4.67 7.4 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.029 2.486 . . . . 0.0 117.787 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' PRO . . . . . 0.512 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 30.6 Cg_endo -63.89 -26.31 67.14 Favored 'Trans proline' 0 C--N 1.371 1.734 0 CA-C-N 123.076 2.134 . . . . 0.0 112.499 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' ILE . . . . . 0.74 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.396 0 CA-C-O 121.438 0.637 . . . . 0.0 110.107 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.3 mp -80.35 96.54 6.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.783 0.325 . . . . 0.0 111.476 -175.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.5 t30 53.06 71.54 0.48 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.792 177.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -124.89 105.35 9.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.188 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -118.47 35.79 4.64 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.9 p 48.15 57.55 6.01 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.987 -175.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -103.07 121.94 43.62 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.545 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.72 1.03 77.86 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.829 -0.701 . . . . 0.0 111.704 -175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.2 t -151.35 134.99 16.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.922 0.392 . . . . 0.0 110.215 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.42 96.53 0.82 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.387 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.9 t 71.93 124.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 123.329 0.652 . . . . 0.0 111.491 178.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.73 -68.24 0.76 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.378 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.742 ' H ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -69.42 -23.88 63.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.658 0.742 . . . . 0.0 110.269 -179.264 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.496 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 103.99 103.17 2.79 Favored Glycine 0 N--CA 1.441 -0.985 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -169.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.544 ' O ' ' HB ' ' A' ' 99' ' ' THR . 2.4 ppt_? -75.02 -8.58 56.94 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -173.534 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -94.89 149.2 21.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 173.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.76 ' HG3' ' HA2' ' A' ' 103' ' ' GLY . 7.9 tt0 -83.62 119.09 73.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -165.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.52 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 5.8 Cg_exo -78.6 -164.53 0.28 Allowed 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.876 3.051 . . . . 0.0 112.125 171.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp -52.3 132.78 34.46 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 122.777 0.431 . . . . 0.0 111.183 178.363 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.721 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -80.76 87.81 5.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.273 0.559 . . . . 0.0 111.435 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.653 ' HD2' ' N ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -98.5 -25.06 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.106 175.913 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.653 ' N ' ' HD2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -50.73 151.32 2.45 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.389 -178.326 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.68 ' HD2' ' H ' ' A' ' 36' ' ' LYS . 1.2 mptt -96.05 159.95 31.06 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.681 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.54 ' HB2' ' CG1' ' A' ' 120' ' ' VAL . 13.8 Cg_exo -67.44 135.88 37.93 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.88 1.72 . . . . 0.0 111.063 174.079 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.653 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 32.5 ttpt -111.71 141.47 45.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.276 -0.42 . . . . 0.0 112.078 -168.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 1.063 ' HE1' HG23 ' A' ' 120' ' ' VAL . 3.1 p-90 147.51 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 O-C-N 125.281 1.613 . . . . 0.0 110.357 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.591 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.73 171.28 7.68 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.042 -176.847 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.64 ' HG ' ' HB3' ' A' ' 53' ' ' LYS . 15.0 m -64.61 133.28 51.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.776 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -71.43 -31.86 67.7 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -129.51 85.24 59.38 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.84 170.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.49 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 4.3 Cg_exo -75.86 134.23 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.417 2.078 . . . . 0.0 110.534 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.681 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 90.8 mtp -102.98 -81.99 0.5 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.963 0.411 . . . . 0.0 110.699 -178.513 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.895 HG21 HD22 ' A' ' 139' ' ' LEU . 75.4 p -115.37 -177.12 3.07 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.218 178.398 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -53.14 -49.64 66.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.263 0.352 . . . . 0.0 111.197 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.57 -48.03 84.16 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.127 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.681 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 75.3 mm-40 -61.82 -45.08 95.38 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.465 HD21 HG12 ' A' ' 130' ' ' ILE . 57.5 tp -58.98 -57.35 13.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.621 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.436 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.8 ptm180 -63.51 -45.05 92.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.6 m -64.79 -53.02 53.59 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 121.23 -0.188 . . . . 0.0 111.013 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.64 ' HB3' ' HG ' ' A' ' 41' ' ' SER . 0.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.419 -0.513 . . . . 0.0 111.269 179.562 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.542 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 45.6 ttp180 -53.34 -53.52 49.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.658 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -66.26 -43.71 85.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.69 -177.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -51.7 -52.24 49.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.241 176.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -71.38 -36.86 71.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.69 0.281 . . . . 0.0 110.728 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.542 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -49.83 -41.61 45.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.587 176.539 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -58.22 -28.57 64.97 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.723 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.7 m -103.05 -0.22 31.07 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.458 -172.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.817 ' HB1' ' HD3' ' A' ' 62' ' ' PRO . . . -75.58 -75.58 0.1 OUTLIER Pre-proline 0 CA--C 1.544 0.737 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -173.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.817 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 77.7 Cg_endo -81.02 -23.82 5.12 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 121.389 1.392 . . . . 0.0 113.478 -167.776 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 56.2 -106.42 0.32 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.881 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.574 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -110.98 -23.04 11.19 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.512 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.574 ' HB2' ' O ' ' A' ' 64' ' ' PHE . 29.7 mt-10 76.03 -172.6 0.1 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.664 0.786 . . . . 0.0 109.8 -168.585 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.404 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . -146.51 -55.82 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 119.664 -1.255 . . . . 0.0 114.375 -172.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.768 ' HB3' HG21 ' A' ' 70' ' ' ILE . 13.1 tpt180 -155.76 106.95 2.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.729 0.299 . . . . 0.0 110.385 -169.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.487 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 75.7 mmtt -63.76 -28.36 69.83 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.351 0.596 . . . . 0.0 109.708 174.373 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.55 ' HB2' ' HG3' ' A' ' 67' ' ' ARG . 18.1 mm-40 -59.63 -40.15 86.66 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.634 177.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.768 HG21 ' HB3' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -82.68 -23.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.991 -178.586 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.67 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -48.71 -38.42 21.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.799 -177.258 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -52.6 -40.98 63.25 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.196 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 -32.91 59.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.266 0.555 . . . . 0.0 110.294 -176.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.573 HD22 HD13 ' A' ' 70' ' ' ILE . 32.4 mt -68.4 -43.72 76.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.929 -175.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.3 ptpt -74.56 -30.45 61.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.451 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.36 -35.68 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.967 0.413 . . . . 0.0 110.483 175.744 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.0 -45.09 75.06 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.352 176.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.561 ' HA ' HD12 ' A' ' 105' ' ' LEU . . . -50.04 -39.33 41.54 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.57 0.544 . . . . 0.0 110.805 171.088 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.429 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 71.3 t60 -60.9 -51.0 71.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.473 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.479 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.31 -50.03 69.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.774 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -60.25 -37.23 79.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.433 -177.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.448 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -60.46 -32.04 71.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 110.724 174.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.461 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 11.3 m -89.36 16.94 6.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.44 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.461 ' HB2' ' O ' ' A' ' 83' ' ' SER . 52.3 m-80 77.5 3.55 3.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.831 0.852 . . . . 0.0 111.741 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.521 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 7.3 m-20 -80.24 84.68 5.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 110.324 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.446 ' HD2' ' HG2' ' A' ' 33' ' ' LYS . 55.5 m80 -70.93 -43.24 68.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.972 178.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -63.75 -39.64 94.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.139 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.521 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 12.1 mt -60.11 -49.0 79.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.795 0.331 . . . . 0.0 110.823 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.642 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -64.54 -34.16 77.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.127 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -64.8 -44.64 89.27 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.723 0.297 . . . . 0.0 110.784 173.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . 0.502 ' O ' ' HA3' ' A' ' 95' ' ' GLY . . . -67.63 -21.26 65.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.909 -177.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.5 mt -83.3 -61.62 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.433 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 89' ' ' ALA . 7.9 mm -56.46 -62.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.517 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.599 ' OD1' ' HB3' ' A' ' 30' ' ' GLN . 3.5 m-20 -72.53 -14.59 61.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.358 -178.671 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . 0.502 ' HA3' ' O ' ' A' ' 91' ' ' ALA . . . -74.13 -21.62 78.82 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.174 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.513 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -83.01 -55.62 4.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 110.647 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.513 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 4.5 t-20 156.31 -30.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -176.122 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.961 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -54.24 137.05 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 112.936 -1.938 . . . . 0.0 110.947 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.544 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 11.2 p -144.57 174.14 11.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.324 0.583 . . . . 0.0 112.175 -175.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.728 HD13 ' O ' ' A' ' 107' ' ' GLU . 82.8 mt -145.73 137.31 12.94 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.463 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.496 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 73.8 Cg_endo -80.33 -6.94 13.91 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.312 1.341 . . . . 0.0 110.45 164.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -80.79 -59.65 2.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.893 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.76 ' HA2' ' HG3' ' A' ' 30' ' ' GLN . . . 95.19 40.74 4.19 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.083 -1.055 . . . . 0.0 111.912 -172.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.496 ' HB1' ' CB ' ' A' ' 35' ' ' GLU . . . -115.77 153.4 31.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.323 0.582 . . . . 0.0 111.476 -177.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.561 HD12 ' HA ' ' A' ' 78' ' ' ALA . 2.0 tm? -91.25 -16.44 27.6 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.4 p -91.91 9.68 31.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.947 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.728 ' O ' HD13 ' A' ' 100' ' ' LEU . 27.6 mt-10 -145.59 151.96 38.93 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.409 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.504 ' SG ' HD21 ' A' ' 74' ' ' LEU . 94.4 m -155.86 138.73 15.3 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.385 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -115.73 123.06 47.33 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.717 0.77 . . . . 0.0 110.09 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.961 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.8 t70 -91.75 152.67 20.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.247 -1.342 . . . . 0.0 110.307 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.5 -23.43 65.91 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.244 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.416 ' HB2' ' ND2' ' A' ' 114' ' ' ASN . 21.4 mt -78.83 1.83 22.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.959 0.409 . . . . 0.0 111.014 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.67 26.81 12.4 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.941 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 90.2 m-20 -101.98 155.27 18.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.888 -173.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -138.52 137.46 37.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.084 0.469 . . . . 0.0 110.609 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . 0.493 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 13.0 m-85 -117.76 132.45 56.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.437 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 6.2 mm-40 -123.86 121.36 35.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 -176.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 33.9 tp -103.75 120.59 50.94 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -169.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.58 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 21.2 Cg_exo -71.38 156.42 58.64 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 123.869 3.046 . . . . 0.0 112.79 175.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 1.063 HG23 ' HE1' ' A' ' 39' ' ' TRP . 21.1 m -67.72 -18.75 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.896 -172.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 0.58 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 3.9 p90 -61.01 -18.13 56.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.843 0.354 . . . . 0.0 111.546 -170.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.9 t -103.44 -0.56 29.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.436 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -137.08 -54.35 0.7 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -175.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.459 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -135.11 119.34 13.4 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.517 -170.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.42 ' N ' ' CD ' ' A' ' 126' ' ' PRO . 68.7 Cg_endo -101.48 21.64 0.19 Allowed 'Trans proline' 0 CA--C 1.558 1.69 0 C-N-CA 122.945 2.43 . . . . 0.0 117.002 178.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.459 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 41.9 Cg_endo -70.04 -34.49 13.56 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-N 122.339 1.871 . . . . 0.0 111.897 175.471 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.745 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER -81.61 51.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.56 0.695 . . . . 0.0 110.852 179.114 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -121.72 -42.03 2.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.24 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' MET . . . . . 0.725 ' HA ' ' HE3' ' A' ' 129' ' ' MET . 3.0 tpt -94.59 -49.77 5.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.883 0.373 . . . . 0.0 110.411 179.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.472 HG23 ' HB2' ' A' ' 44' ' ' PRO . 17.0 mm 72.5 -73.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.595 176.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.409 ' HA ' HG13 ' A' ' 136' ' ' ILE . 3.3 pt-20 -76.23 71.16 2.93 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.919 -174.12 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -90.44 179.74 5.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.466 172.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.478 ' HE2' ' O ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -85.43 29.7 0.66 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.289 0.566 . . . . 0.0 110.853 -178.652 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 4.0 p -80.49 -17.28 52.11 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.33 171.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -162.95 -48.3 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.986 176.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.409 HG13 ' HA ' ' A' ' 131' ' ' GLU . 19.0 mm -66.68 138.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.511 . . . . 0.0 111.632 -175.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -139.5 -55.88 0.58 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.591 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 37.8 m -151.33 102.28 2.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.622 -177.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.895 HD22 HG21 ' A' ' 46' ' ' THR . 27.4 tp -87.44 78.35 8.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.209 0.528 . . . . 0.0 109.625 174.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -100.7 -27.99 13.08 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.998 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 3.7 pt . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.868 178.377 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.477 0.895 0 CA-C-O 120.798 0.332 . . . . 0.0 110.521 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.412 HD13 ' HA ' ' A' ' 15' ' ' LEU . 3.4 mm? -126.17 122.6 36.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.892 0.377 . . . . 0.0 110.971 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -91.15 91.3 8.18 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.471 ' HA ' ' OE1' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -63.81 153.57 36.2 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.688 0.756 . . . . 0.0 112.107 -174.725 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -96.05 27.31 3.68 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.727 -177.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.8 m -79.9 46.44 0.79 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.188 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.497 ' HG2' HG22 ' A' ' 22' ' ' THR . 40.1 tt0 70.66 -60.07 0.51 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.504 0.722 . . . . 0.0 111.59 177.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . 0.42 ' HA2' ' O ' ' A' ' 24' ' ' VAL . . . 86.66 39.02 7.83 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.126 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.497 HG22 ' HG2' ' A' ' 20' ' ' GLU . 28.0 p -102.03 54.29 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.448 0.642 . . . . 0.0 109.999 175.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.96 23.13 23.7 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -171.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.42 ' O ' ' HA2' ' A' ' 21' ' ' GLY . 96.4 t -140.19 110.32 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -175.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.71 -79.45 0.24 Allowed 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.866 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mp -75.78 -60.86 2.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 122.069 0.937 . . . . 0.0 109.469 175.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.534 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 160.62 100.31 0.16 Allowed Glycine 0 N--CA 1.44 -1.093 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.886 -178.847 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.677 ' O ' ' HB ' ' A' ' 99' ' ' THR . 0.0 OUTLIER -56.62 -32.74 65.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.924 0.392 . . . . 0.0 111.385 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.611 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 30.8 p-10 -108.91 158.7 17.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 170.062 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -80.27 111.32 21.38 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -162.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.616 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 4.8 Cg_exo -79.71 -164.57 0.29 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.743 2.962 . . . . 0.0 109.972 166.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.551 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 28.4 tp -52.74 132.06 35.82 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 176.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.535 ' HE3' ' CZ ' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -57.25 109.53 0.68 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.361 0.6 . . . . 0.0 111.319 -175.656 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.867 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 10.8 mmpt? -97.55 -19.86 18.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.053 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.19 170.07 8.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.493 0.664 . . . . 0.0 111.605 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -109.38 159.85 29.87 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.04 -177.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.491 ' HB2' ' CG1' ' A' ' 120' ' ' VAL . 33.1 Cg_exo -51.29 128.73 26.39 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.567 2.178 . . . . 0.0 112.294 -175.824 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.472 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 24.3 ttpt -113.46 123.21 49.5 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.253 -170.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 1.045 ' HE1' HG23 ' A' ' 120' ' ' VAL . 3.1 p-90 -176.3 25.17 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.666 -1.152 . . . . 0.0 109.441 172.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.449 ' HE2' HG23 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -157.59 166.02 34.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.979 -167.309 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 52.1 m -69.37 128.75 37.66 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 165.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -76.92 -18.31 58.37 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . 0.49 ' CE2' ' HG2' ' A' ' 45' ' ' MET . 51.2 t80 -133.34 75.0 71.05 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.215 170.153 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.77 ' HG2' HG12 ' A' ' 130' ' ' ILE . 50.4 Cg_exo -62.45 -26.36 76.47 Favored 'Trans proline' 0 CA--C 1.508 -0.809 0 C-N-CA 123.853 3.035 . . . . 0.0 113.549 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.49 ' HG2' ' CE2' ' A' ' 43' ' ' TYR . 54.1 mtt 78.18 -82.64 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.696 -1.593 . . . . 0.0 110.797 -177.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.611 ' HA ' ' HG2' ' A' ' 131' ' ' GLU . 67.3 p -115.69 175.85 5.34 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.102 -177.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.604 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 0.8 OUTLIER -68.12 -36.7 80.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.432 0.158 . . . . 0.0 110.618 -177.966 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.08 -41.94 94.83 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.167 -0.54 . . . . 0.0 111.863 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.715 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -74.46 -38.49 62.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.516 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.578 HD21 HD13 ' A' ' 130' ' ' ILE . 59.8 tp -54.48 -54.34 42.28 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.299 0.375 . . . . 0.0 111.15 178.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 14.9 ptm180 -64.51 -47.1 80.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.323 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.1 t -60.64 -45.35 94.38 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.684 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.485 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 65.5 mmtt -72.72 -30.09 63.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.495 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -57.94 -41.32 82.54 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.55 -50.64 35.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.438 0.637 . . . . 0.0 110.745 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -54.91 -46.85 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.633 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.485 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 34.0 m-85 -70.48 -36.43 73.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.467 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -30.58 48.0 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.388 0.43 . . . . 0.0 111.223 176.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -60.62 -34.25 73.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 112.074 173.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 m -100.0 -27.1 13.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.977 -171.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.499 ' HB1' ' HD3' ' A' ' 62' ' ' PRO . . . -52.1 -52.93 57.48 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -175.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.499 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 49.4 Cg_endo -84.48 -7.18 9.85 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.166 1.911 . . . . 0.0 112.877 -177.16 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 61.86 -116.31 0.6 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.398 -176.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.509 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 22.7 m-85 -109.37 -47.08 3.45 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.225 0.536 . . . . 0.0 110.684 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . 0.509 ' HG2' ' O ' ' A' ' 64' ' ' PHE . 55.2 mm-40 -163.23 177.63 8.87 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.21 -178.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.488 ' HA2' ' OD1' ' A' ' 114' ' ' ASN . . . -133.34 141.84 13.27 Favored Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.347 173.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.589 ' O ' HG21 ' A' ' 70' ' ' ILE . 33.7 mmt180 -66.51 94.72 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 171.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.441 ' HD2' ' HA ' ' A' ' 68' ' ' LYS . 15.1 tptm -50.85 -37.11 41.29 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.793 -171.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -58.41 -33.43 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.752 HD13 HD22 ' A' ' 74' ' ' LEU . 0.8 OUTLIER -82.77 -22.52 8.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.229 -178.618 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.627 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -50.62 -37.2 38.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.808 -173.285 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -59.24 -34.24 71.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.326 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.22 -29.01 42.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.02 0.438 . . . . 0.0 110.091 -178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.752 HD22 HD13 ' A' ' 70' ' ' ILE . 34.2 mt -67.96 -49.27 62.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.467 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.627 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.4 ptpt -69.01 -28.99 67.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.708 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.43 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.74 -38.72 76.92 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.179 176.609 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.497 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -67.95 -51.35 48.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.618 178.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.403 ' HA ' HD12 ' A' ' 105' ' ' LEU . . . -51.54 -34.13 35.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 172.177 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.43 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 28.5 t60 -64.18 -47.55 79.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.133 0.492 . . . . 0.0 109.81 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.422 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -68.85 -53.46 21.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.535 ' CZ ' ' HE3' ' A' ' 33' ' ' LYS . 12.7 t80 -54.44 -28.5 44.55 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.802 177.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -63.17 -28.82 70.32 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.591 -0.693 . . . . 0.0 111.229 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.7 t -92.15 15.26 13.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.469 0.652 . . . . 0.0 109.455 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 57.4 t30 70.71 7.44 6.22 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.012 -178.279 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.425 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 4.7 m-20 -73.84 82.05 1.64 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.199 0.524 . . . . 0.0 110.441 176.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 -72.09 -37.25 69.61 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.458 174.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.412 ' HG3' ' N ' ' A' ' 88' ' ' LEU . 10.2 pt-20 -53.67 -43.7 69.07 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.699 178.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.48 ' O ' HG13 ' A' ' 92' ' ' ILE . 14.5 mt -65.65 -51.93 55.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.981 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.565 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -63.27 -40.11 96.47 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.92 -176.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -66.17 -38.78 88.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.772 0.32 . . . . 0.0 110.195 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.55 -21.0 61.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.666 -179.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.3 mt -81.84 -60.68 2.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.861 177.051 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.565 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -52.66 -61.81 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.416 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.26 -25.25 65.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.564 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -75.24 -12.61 83.41 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.951 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -102.07 6.63 41.09 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.987 -0.126 . . . . 0.0 110.881 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.8 t30 74.14 8.11 4.69 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.982 0.896 . . . . 0.0 109.525 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.937 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -90.51 138.2 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.348 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.677 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 19.8 p -123.19 164.79 18.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.362 -177.038 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.856 HD11 ' HB2' ' A' ' 102' ' ' HIS . 2.6 tm? -150.42 104.11 3.11 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.483 178.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.603 ' HD2' HD21 ' A' ' 100' ' ' LEU . 67.4 Cg_endo -71.62 -7.9 22.12 Favored 'Trans proline' 0 N--CA 1.476 0.475 0 C-N-CA 123.325 2.684 . . . . 0.0 114.216 -173.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.856 ' HB2' HD11 ' A' ' 100' ' ' LEU . 29.7 m-70 -82.72 -15.45 51.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 177.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.616 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 68.77 37.67 84.51 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.275 -176.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.672 ' H ' HD13 ' A' ' 100' ' ' LEU . . . -135.36 152.76 51.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 121.267 0.556 . . . . 0.0 111.572 -175.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.497 HD22 ' HB1' ' A' ' 77' ' ' ALA . 2.6 tm? -79.55 -21.92 44.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.279 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.505 ' O ' ' HB2' ' A' ' 118' ' ' LEU . 37.7 p -87.7 24.09 1.81 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.242 -173.827 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.788 ' HB3' HD22 ' A' ' 100' ' ' LEU . 32.5 mt-10 -156.07 149.56 24.76 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.429 ' SG ' HD21 ' A' ' 74' ' ' LEU . 74.8 m -151.31 139.44 20.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.04 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.486 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 12.5 m-30 -118.72 121.59 40.46 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.89 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.937 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.0 OUTLIER -84.5 145.12 28.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.106 178.915 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -58.6 -31.81 68.4 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 124.649 1.218 . . . . 0.0 111.835 -171.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 16.8 mt -69.36 -40.5 77.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.568 -177.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 141.75 43.6 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.766 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.839 ' HB3' ' HB3' ' A' ' 110' ' ' ASP . 1.8 t-20 -109.14 152.49 25.04 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.287 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.486 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 38.6 ttp180 -134.73 128.03 32.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.785 0.326 . . . . 0.0 110.31 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -117.37 137.97 52.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.808 177.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -122.29 119.45 31.18 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.505 ' HB2' ' O ' ' A' ' 106' ' ' THR . 4.0 mm? -95.53 115.34 65.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -170.384 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.545 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 33.7 Cg_exo -69.21 155.2 68.46 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 124.169 3.246 . . . . 0.0 113.622 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 1.045 HG23 ' HE1' ' A' ' 39' ' ' TRP . 11.1 m -72.69 -23.02 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 114.75 -1.114 . . . . 0.0 112.631 -171.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 0.545 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.6 p90 -55.95 -29.69 60.55 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -168.516 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.6 t -99.32 -1.71 38.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.598 0.237 . . . . 0.0 111.34 -175.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.3 mt -133.85 -71.38 0.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.975 -174.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.69 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -118.76 116.06 34.83 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.606 -170.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -104.16 32.61 0.06 OUTLIER 'Trans proline' 0 CA--C 1.556 1.582 0 C-N-CA 123.045 2.497 . . . . 0.0 116.539 177.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.73 -19.61 18.37 Favored 'Trans proline' 0 C--N 1.367 1.506 0 CA-C-N 121.945 1.73 . . . . 0.0 111.68 172.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.592 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.0 OUTLIER -90.91 52.74 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.471 0.653 . . . . 0.0 109.921 176.495 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -112.27 -56.63 2.37 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.297 -177.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 41.4 ttp -104.35 89.66 3.31 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.77 HG12 ' HG2' ' A' ' 44' ' ' PRO . 3.4 mp -75.59 -52.09 19.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.246 -178.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.611 ' HG2' ' HA ' ' A' ' 46' ' ' THR . 7.5 mt-10 -62.56 100.62 0.2 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.437 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.77 -106.0 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.032 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.401 ' HD3' ' C ' ' A' ' 133' ' ' LYS . 1.8 tmtt? -76.23 -69.46 0.5 Allowed 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 173.355 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.3 t 38.24 -108.88 0.07 Allowed 'General case' 0 CA--C 1.535 0.374 0 O-C-N 123.955 0.785 . . . . 0.0 111.984 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -115.94 -8.24 11.91 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.196 0.522 . . . . 0.0 111.236 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 46.7 mm -55.62 139.87 14.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.942 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 44.76 42.0 5.55 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.22 -175.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 24.6 m -133.65 126.76 31.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.783 0.325 . . . . 0.0 110.626 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.8 tp -142.3 44.4 1.65 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.843 0.83 . . . . 0.0 110.322 177.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -122.59 10.97 9.79 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.111 -0.95 . . . . 0.0 108.725 175.178 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 2.6 pt . . . . . 0 C--O 1.247 0.954 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.12 -174.318 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -98.88 39.55 1.26 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.214 0.53 . . . . 0.0 110.158 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -122.94 33.17 5.48 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.303 0.573 . . . . 0.0 110.197 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -87.93 52.77 2.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.991 -174.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -82.73 15.41 2.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.914 -173.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.4 m -116.7 7.37 13.48 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.316 0.579 . . . . 0.0 109.77 175.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.522 ' HA ' ' H ' ' A' ' 24' ' ' VAL . 26.6 tt0 -78.35 12.9 1.72 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.249 -173.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -59.07 -33.75 75.99 Favored Glycine 0 C--N 1.331 0.271 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 173.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.8 t -111.22 23.12 14.44 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.328 0.585 . . . . 0.0 109.674 175.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.0 50.66 63.32 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.765 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.825 HG23 ' HG3' ' A' ' 28' ' ' ARG . 25.4 t -143.07 118.65 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-O 121.143 0.497 . . . . 0.0 109.791 -177.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.37 -70.11 0.39 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.795 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.644 ' H ' HD12 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -115.54 -18.21 10.99 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.613 -0.435 . . . . 0.0 111.887 -178.678 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.738 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 141.78 87.02 0.1 Allowed Glycine 0 C--O 1.222 -0.627 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.771 176.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.825 ' HG3' HG23 ' A' ' 24' ' ' VAL . 8.8 mtt180 -62.24 -30.69 71.28 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.548 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 8.7 p30 -109.67 161.51 15.32 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -176.48 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.601 ' HA ' ' HA2' ' A' ' 103' ' ' GLY . 26.2 tt0 -79.67 109.27 11.25 Favored Pre-proline 0 CA--C 1.534 0.331 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -165.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.943 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 73.2 Cg_endo -76.63 -165.29 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.335 2.69 . . . . 0.0 111.425 171.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.612 HD21 ' HE3' ' A' ' 34' ' ' LYS . 17.9 tp -48.33 138.06 10.38 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.189 0.518 . . . . 0.0 111.119 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.793 ' HG2' ' HB2' ' A' ' 105' ' ' LEU . 0.4 OUTLIER -76.9 94.15 3.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.874 -172.136 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.612 ' HE3' HD21 ' A' ' 32' ' ' LEU . 32.8 mmtp -98.68 -42.28 7.31 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HG2' ' HZ1' ' A' ' 38' ' ' LYS . 9.4 tp10 -68.66 156.45 38.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.638 0.732 . . . . 0.0 112.543 -169.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.488 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 35.7 mmtm -95.08 160.93 29.82 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.251 -179.593 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.777 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 20.6 Cg_exo -66.44 138.37 50.2 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.239 1.959 . . . . 0.0 112.41 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.72 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 3.7 mtmt -110.76 148.98 31.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.847 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 1.01 ' HE1' HG23 ' A' ' 120' ' ' VAL . 0.8 OUTLIER 125.64 -4.52 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.105 0 O-C-N 126.047 2.092 . . . . 0.0 108.945 -171.186 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.778 ' HZ1' ' HB3' ' A' ' 40' ' ' LYS . 0.0 OUTLIER -115.94 151.9 34.5 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.563 -167.466 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.538 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 58.4 m -64.98 149.08 50.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.456 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -56.81 -50.57 71.98 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -139.22 102.6 7.38 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.548 171.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.532 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 15.0 Cg_exo -67.88 131.63 24.53 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.077 1.851 . . . . 0.0 109.828 172.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.401 ' HB3' ' H ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -91.76 -81.3 0.33 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.742 -175.417 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.642 ' HB ' HG23 ' A' ' 136' ' ' ILE . 43.1 p -115.17 -175.52 2.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.894 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.493 ' HB2' ' OE2' ' A' ' 131' ' ' GLU . 9.0 t70 -68.13 -36.53 79.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.788 0.328 . . . . 0.0 111.133 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.519 ' O ' ' HG2' ' A' ' 51' ' ' ARG . . . -63.07 -42.14 99.64 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.881 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -68.16 -37.7 81.3 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.4 tt -59.47 -55.33 35.97 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.029 178.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.519 ' HG2' ' O ' ' A' ' 48' ' ' GLY . 5.9 ptp180 -58.7 -46.99 86.07 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.754 0.311 . . . . 0.0 111.756 -176.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.466 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 74.2 m -67.35 -52.06 44.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.171 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -66.64 -32.67 74.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.242 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 54' ' ' ARG . 11.0 ttm180 -55.41 -48.29 74.6 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.22 -47.99 77.56 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.654 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 52' ' ' SER . 59.8 mt-10 -52.64 -48.47 66.39 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.762 177.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -66.1 -40.33 90.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.574 178.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.449 ' HA ' ' HB2' ' A' ' 61' ' ' ALA . 7.1 m95 -54.1 -31.36 51.81 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 177.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -66.96 -19.07 65.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.855 0.359 . . . . 0.0 111.27 176.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.8 m -108.27 -16.46 14.24 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.603 0.716 . . . . 0.0 110.224 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.836 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -76.88 169.61 20.34 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.303 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.836 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 36.0 Cg_endo -60.1 -50.78 6.71 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.546 2.164 . . . . 0.0 113.069 -176.259 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 55.42 -107.44 0.38 Allowed 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.833 -177.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -108.7 -12.13 14.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -175.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -74.82 152.18 38.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.214 0.53 . . . . 0.0 111.899 -171.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 115.0 -127.89 7.87 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.722 176.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.482 ' O ' HG23 ' A' ' 70' ' ' ILE . 5.3 mmp_? -143.36 126.62 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 122.72 0.408 . . . . 0.0 109.992 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -71.02 -26.82 63.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.084 0.469 . . . . 0.0 110.072 176.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -60.53 -43.1 97.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.945 179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.773 HD11 ' HB2' ' A' ' 110' ' ' ASP . 0.0 OUTLIER -80.8 -23.42 10.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.189 -176.637 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.558 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 2.0 m95 -52.5 -37.11 56.62 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -177.33 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -58.11 -35.36 71.33 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.278 0.361 . . . . 0.0 111.08 -177.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.25 -29.85 57.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.108 0.48 . . . . 0.0 110.555 -178.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.509 HD22 ' CD1' ' A' ' 70' ' ' ILE . 16.8 mt -67.72 -53.4 27.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.185 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.7 ptpt -65.13 -30.42 71.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.898 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.406 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.84 -36.97 76.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.103 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.08 -50.38 48.86 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.601 0.239 . . . . 0.0 110.438 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -31.92 61.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.406 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 24.5 t60 -63.78 -47.37 81.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 109.846 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.47 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -70.99 -52.37 20.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.827 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.548 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 21.0 t80 -57.28 -35.14 69.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.486 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.06 -27.13 68.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.943 0.401 . . . . 0.0 111.322 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -94.97 22.11 6.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.28 177.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.6 m120 77.02 0.96 3.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.648 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.756 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 2.0 m-20 -77.46 84.37 3.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.321 0.581 . . . . 0.0 110.705 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.422 ' HD2' ' HD2' ' A' ' 33' ' ' LYS . 60.0 m80 -71.92 -39.68 69.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.947 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.523 ' HA ' ' NE2' ' A' ' 90' ' ' GLN . 11.5 pt-20 -69.82 -37.71 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.385 -177.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.756 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -62.99 -51.22 67.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.931 0.396 . . . . 0.0 110.768 -179.846 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.807 ' HB3' HD21 ' A' ' 105' ' ' LEU . . . -62.34 -46.43 88.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.576 -175.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.523 ' NE2' ' HA ' ' A' ' 87' ' ' GLU . 10.7 pt20 -63.79 -34.46 77.96 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.59 0.233 . . . . 0.0 110.528 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.17 -26.61 62.15 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.918 0.39 . . . . 0.0 110.557 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.8 mt -72.01 -47.06 56.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 174.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.773 HG22 HG22 ' A' ' 98' ' ' ILE . 9.7 mm -49.8 -61.83 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.529 173.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.166 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.56 -23.9 70.71 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.44 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.53 ' HB1' HD12 ' A' ' 98' ' ' ILE . . . -99.97 9.27 43.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.154 -178.023 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 62.6 t30 69.85 11.93 7.85 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.83 1.3 . . . . 0.0 108.882 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.773 HG22 HG22 ' A' ' 93' ' ' ILE . 51.2 mt -83.88 141.0 15.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 113.343 -1.753 . . . . 0.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.63 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 30.0 p -134.5 168.6 18.66 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.101 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.531 HD22 ' HA ' ' A' ' 108' ' ' CYS . 4.0 mt -150.2 106.5 3.17 Favored Pre-proline 0 N--CA 1.449 -0.506 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.05 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.738 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 24.9 Cg_endo -63.14 -26.36 72.89 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 121.431 1.421 . . . . 0.0 110.574 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -77.23 -20.89 54.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.798 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.943 ' HA3' ' HD2' ' A' ' 31' ' ' PRO . . . 55.96 38.26 74.27 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 114.819 -1.082 . . . . 0.0 114.18 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -110.93 149.21 30.97 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.756 0.313 . . . . 0.0 110.978 -177.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.807 HD21 ' HB3' ' A' ' 89' ' ' ALA . 0.3 OUTLIER -78.84 -24.41 44.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.909 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.777 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 47.4 p -85.21 26.82 0.85 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.583 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' A' ' 117' ' ' GLN . 20.1 mt-10 -165.48 156.98 14.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.261 175.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.531 ' HA ' HD22 ' A' ' 100' ' ' LEU . 86.9 m -156.22 139.86 15.99 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 172.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.508 ' CD2' ' HD2' ' A' ' 101' ' ' PRO . 18.3 m-30 -116.87 121.98 43.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.972 0.891 . . . . 0.0 110.266 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.862 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 3.5 t70 -80.48 149.07 30.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.249 -177.518 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -59.66 -25.97 65.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.933 -1.03 . . . . 0.0 112.714 -168.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -74.8 -9.6 58.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.208 0.528 . . . . 0.0 110.642 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.16 26.04 6.17 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.95 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.862 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 64.5 m-80 -94.73 150.24 20.41 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.409 ' HA ' ' HD1' ' A' ' 109' ' ' TYR . 10.3 ptp180 -123.37 144.69 49.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.045 0.45 . . . . 0.0 109.881 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -136.01 142.45 44.47 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.155 174.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.464 ' HA ' ' HG2' ' A' ' 107' ' ' GLU . 45.7 mt-30 -122.31 119.9 32.49 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.403 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -85.67 112.5 45.13 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.45 -171.658 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.566 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 37.0 Cg_exo -69.16 154.71 69.68 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.586 2.857 . . . . 0.0 113.404 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 1.01 HG23 ' HE1' ' A' ' 39' ' ' TRP . 32.6 m -61.52 -16.82 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.94 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 0.566 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.7 p90 -59.24 -21.02 58.91 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -169.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 20.6 t -126.88 14.44 7.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.013 0.435 . . . . 0.0 110.688 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.651 HD12 HG22 ' A' ' 106' ' ' THR . 65.7 mt -132.54 -53.04 0.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.949 0.404 . . . . 0.0 111.902 -176.215 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.563 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -128.05 114.88 20.33 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-O 120.712 0.291 . . . . 0.0 110.953 -173.395 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.434 ' N ' ' CD ' ' A' ' 126' ' ' PRO . 75.6 Cg_endo -96.99 16.21 0.7 Allowed 'Trans proline' 0 CA--C 1.558 1.719 0 C-N-CA 123.012 2.475 . . . . 0.0 117.162 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.563 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 39.9 Cg_endo -68.66 -16.32 42.13 Favored 'Trans proline' 0 C--N 1.371 1.742 0 CA-C-N 122.486 1.924 . . . . 0.0 111.656 173.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.591 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER -110.62 46.69 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.202 177.467 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -91.51 -36.75 13.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.875 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' MET . . . . . 0.413 ' HG3' ' O ' ' A' ' 131' ' ' GLU . 39.6 tpp -115.89 -43.32 3.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 5.2 mp 69.17 -70.95 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 123.254 0.622 . . . . 0.0 111.697 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.493 ' OE2' ' HB2' ' A' ' 47' ' ' ASP . 9.2 pt-20 -74.75 154.2 38.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.292 -178.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -87.91 164.97 15.58 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt 20.38 -89.03 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 O-C-N 125.356 1.66 . . . . 0.0 113.902 -174.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 20.9 t 179.36 81.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 -176.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -134.05 -41.02 0.83 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.989 -178.525 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.67 HG22 ' HG3' ' A' ' 137' ' ' GLU . 47.6 mm -36.06 -80.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 124.438 1.086 . . . . 0.0 113.607 -174.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.67 ' HG3' HG22 ' A' ' 136' ' ' ILE . 84.3 mt-10 -117.26 37.09 3.98 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.041 0.448 . . . . 0.0 110.67 177.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 19.3 m -82.69 78.07 9.36 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.018 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 22.0 tp -93.14 139.49 30.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.036 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -98.27 -28.55 13.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.83 0.348 . . . . 0.0 110.927 -175.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 28.7 pt . . . . . 0 C--O 1.247 0.962 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.418 -178.845 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.895 0.379 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -79.33 83.91 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.091 0.472 . . . . 0.0 111.005 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -154.28 134.57 13.31 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 177.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -80.59 -19.34 45.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.828 0.347 . . . . 0.0 110.381 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -84.48 152.39 23.99 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.9 p -79.11 46.18 0.69 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.425 ' CG ' ' HB3' ' A' ' 25' ' ' ALA . 24.6 mm-40 64.98 116.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.205 0.602 . . . . 0.0 112.175 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.28 -15.1 81.35 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.2 p -62.51 -24.86 67.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.346 -0.427 . . . . 0.0 110.942 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 131.32 71.89 0.1 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.625 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.0 t 73.52 125.26 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-O 121.597 0.713 . . . . 0.0 112.321 174.563 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.425 ' HB3' ' CG ' ' A' ' 20' ' ' GLU . . . -103.73 -88.13 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.334 175.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.445 HD21 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.91 -16.0 60.1 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.002 -178.139 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.579 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 112.03 98.45 2.41 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.562 177.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.655 HH11 ' HB3' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -67.38 -27.15 66.86 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 121.426 0.631 . . . . 0.0 110.401 175.087 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.655 ' HB3' HH11 ' A' ' 28' ' ' ARG . 4.9 p-10 -97.28 160.33 14.39 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.753 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -81.37 106.29 5.57 Favored Pre-proline 0 C--N 1.326 -0.431 0 O-C-N 123.589 0.555 . . . . 0.0 112.36 -169.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.687 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 91.4 Cg_endo -79.59 -164.99 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 123.284 2.656 . . . . 0.0 111.222 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.2 mp -50.58 137.65 19.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.785 0.326 . . . . 0.0 110.757 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.711 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -75.43 100.62 4.53 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.375 1.083 . . . . 0.0 111.201 -171.007 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -98.4 -19.14 17.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.228 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.804 ' HB3' ' HB1' ' A' ' 104' ' ' ALA . 4.0 tp10 -95.67 149.26 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.091 0.472 . . . . 0.0 110.751 -174.168 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -98.73 161.47 24.91 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.617 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.679 ' HG3' HG23 ' A' ' 106' ' ' THR . 32.0 Cg_exo -55.58 142.23 81.98 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.617 2.211 . . . . 0.0 112.995 -177.286 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.654 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 36.2 ttpt -111.54 135.69 51.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.384 -170.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 1.093 ' HE1' HG23 ' A' ' 120' ' ' VAL . 1.4 p-90 152.01 -17.25 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.792 1.307 . . . . 0.0 110.961 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.459 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.41 164.51 13.51 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.573 0.225 . . . . 0.0 110.881 -174.664 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 39.7 m -65.27 119.73 11.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.839 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . 0.406 ' HA ' ' HZ2' ' A' ' 40' ' ' LYS . 16.3 t0 -67.5 -28.76 68.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.62 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -126.18 89.77 51.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.369 167.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.57 ' HB2' HG13 ' A' ' 130' ' ' ILE . 3.4 Cg_exo -79.16 137.12 13.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.973 2.449 . . . . 0.0 112.262 177.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.498 ' HB3' ' H ' ' A' ' 46' ' ' THR . 12.4 mmm -108.03 -137.64 0.37 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 174.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.498 ' H ' ' HB3' ' A' ' 45' ' ' MET . 47.5 p -81.03 -175.19 5.28 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.783 -177.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.487 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 21.0 t70 -56.69 -49.58 74.69 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -168.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.07 -36.14 91.85 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.706 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -72.37 -44.17 62.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 0.0 110.263 175.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.436 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 50.6 tp -60.3 -45.52 93.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.807 -178.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 12.4 ptp180 -64.68 -50.84 65.42 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.455 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 26.7 t -64.07 -57.38 9.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.693 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.5 ' O ' ' HB2' ' A' ' 57' ' ' PHE . 2.0 tppt? -63.99 -28.05 69.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.138 -174.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 40.5 ttm180 -58.1 -45.65 86.86 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 172.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.2 -49.32 61.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.417 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 2.0 mp0 -50.36 -47.36 56.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.541 0.686 . . . . 0.0 110.495 174.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -69.4 -38.81 78.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.832 -179.246 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.503 ' CE3' ' HB2' ' A' ' 61' ' ' ALA . 2.3 m95 -53.2 -29.48 32.24 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.417 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 9.4 t70 -58.15 -27.16 63.54 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.492 0.663 . . . . 0.0 110.767 172.499 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.9 m -105.59 13.16 30.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.542 0.687 . . . . 0.0 110.096 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.976 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -99.33 175.81 2.26 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.976 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 31.6 Cg_endo -60.29 -6.02 4.78 Favored 'Trans proline' 0 C--N 1.365 1.419 0 C-N-CA 124.657 3.571 . . . . 0.0 116.001 -170.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -39.18 -46.73 1.52 Allowed 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -173.309 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -81.49 -9.13 59.77 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -173.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 42.27 -136.47 0.29 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.249 1.02 . . . . 0.0 112.358 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -179.88 -102.05 0.16 Allowed Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.555 -0.618 . . . . 0.0 111.555 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.625 ' O ' HG21 ' A' ' 70' ' ' ILE . 4.0 mmp_? -108.74 96.13 6.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 110.54 -0.17 . . . . 0.0 110.54 177.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.538 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 16.7 tptm -45.74 -35.09 4.03 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.222 0.609 . . . . 0.0 111.726 178.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -50.57 -40.25 51.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.12 179.637 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.632 HD13 HD22 ' A' ' 74' ' ' LEU . 0.9 OUTLIER -82.83 -22.1 9.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -175.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.538 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.09 -40.18 14.7 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 122.866 0.467 . . . . 0.0 111.881 -171.932 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.91 -36.84 70.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.581 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.61 -26.04 45.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.159 0.504 . . . . 0.0 110.296 -176.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.632 HD22 HD13 ' A' ' 70' ' ' ILE . 51.4 mt -70.29 -46.31 64.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.611 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.708 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 0.4 OUTLIER -72.71 -25.85 61.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.716 177.179 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.425 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -68.26 -39.67 82.14 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.726 0.298 . . . . 0.0 110.702 174.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.8 -47.35 75.4 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.483 176.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.671 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -49.96 -39.65 41.33 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.597 171.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.425 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 22.3 t60 -62.33 -47.69 83.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.224 -178.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.618 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -65.12 -53.95 37.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 177.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.615 ' HE1' ' HE3' ' A' ' 33' ' ' LYS . 9.6 t80 -53.94 -30.51 46.84 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.423 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.671 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.0 mt-10 -56.64 -40.66 75.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 175.063 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -84.96 20.34 1.88 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.463 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.7 t30 71.59 9.65 6.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.217 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.618 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 2.5 t0 -80.79 83.77 6.47 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.489 0.661 . . . . 0.0 110.536 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -72.56 -41.55 65.61 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.094 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.08 -43.8 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.286 -176.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.481 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.0 mt -55.58 -52.79 62.57 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 120.802 0.334 . . . . 0.0 110.771 175.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.629 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -61.74 -47.3 85.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.792 -176.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -27.67 65.71 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.61 -177.781 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -74.76 -32.56 62.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.846 0.355 . . . . 0.0 110.254 176.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.481 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.3 mt -68.76 -57.2 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.349 176.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.629 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -51.03 -61.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.208 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.415 ' HA ' ' O ' ' A' ' 98' ' ' ILE . 21.1 t70 -71.33 -18.25 62.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.252 -174.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.96 -11.52 70.02 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.121 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.477 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -108.93 8.68 26.52 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.097 -0.061 . . . . 0.0 111.029 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.477 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.1 m-80 72.95 4.34 4.94 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.313 0.578 . . . . 0.0 110.392 -173.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 1.145 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -83.73 134.88 25.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.736 172.681 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.529 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 21.3 p -138.97 166.36 24.69 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.772 -177.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.708 HD13 ' H ' ' A' ' 104' ' ' ALA . 2.4 tm? -148.12 104.34 3.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.743 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.579 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 32.1 Cg_endo -63.81 -30.54 68.5 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.195 2.597 . . . . 0.0 113.779 -173.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.54 ' HB2' HD11 ' A' ' 100' ' ' LEU . 13.0 m-70 -68.29 -9.55 48.45 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.67 0.272 . . . . 0.0 111.671 179.265 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.711 ' O ' ' HA ' ' A' ' 33' ' ' LYS . . . 73.49 18.29 79.34 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.328 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.804 ' HB1' ' HB3' ' A' ' 35' ' ' GLU . . . -95.01 140.31 30.15 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.511 0.672 . . . . 0.0 111.373 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' A' ' 78' ' ' ALA . 2.5 tm? -83.15 -16.34 47.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.184 175.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.679 HG23 ' HG3' ' A' ' 37' ' ' PRO . 59.8 p -91.07 14.99 12.51 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.05 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.527 ' HB3' HD22 ' A' ' 100' ' ' LEU . 28.9 mt-10 -149.84 144.71 26.14 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 78.9 m -150.86 138.33 19.56 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 175.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.436 ' CD1' ' HG2' ' A' ' 115' ' ' ARG . 16.3 m-30 -116.93 122.5 44.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.511 0.672 . . . . 0.0 109.533 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 1.145 ' HA ' HG13 ' A' ' 98' ' ' ILE . 2.6 t70 -81.38 148.29 29.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.021 -173.43 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -55.26 -27.74 48.56 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 124.551 1.157 . . . . 0.0 112.645 -171.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.4 mt -78.95 -7.37 57.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.944 0.402 . . . . 0.0 110.874 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 23.44 7.27 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.182 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.98 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 59.1 m-80 -92.58 161.63 14.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.779 0.323 . . . . 0.0 110.904 -176.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.436 ' HG2' ' CD1' ' A' ' 109' ' ' TYR . 78.0 mtt180 -129.82 128.13 41.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.07 0.462 . . . . 0.0 111.187 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . 0.592 ' HE1' ' H ' ' A' ' 67' ' ' ARG . 20.2 m-85 -117.98 124.06 47.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.715 171.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -123.88 121.14 34.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.048 -171.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.572 HD22 HG22 ' A' ' 106' ' ' THR . 38.0 tp -98.99 119.82 59.96 Favored Pre-proline 0 C--N 1.319 -0.757 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -170.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.621 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 24.5 Cg_exo -69.38 156.2 65.03 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.313 2.675 . . . . 0.0 112.739 174.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 1.093 HG23 ' HE1' ' A' ' 39' ' ' TRP . 33.7 m -66.81 -15.79 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.273 -175.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 0.621 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.3 p90 -58.67 -21.65 54.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.944 0.402 . . . . 0.0 111.865 -172.327 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 37.0 t -101.61 2.4 38.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.179 -175.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 61.9 mt -139.6 -52.05 0.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.447 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -137.37 114.37 9.67 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.991 -173.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 88.5 Cg_endo -103.3 27.19 0.1 OUTLIER 'Trans proline' 0 CA--C 1.555 1.556 0 C-N-CA 122.973 2.448 . . . . 0.0 117.043 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.418 ' HD2' HD11 ' A' ' 127' ' ' ILE . 80.7 Cg_endo -81.35 -19.04 8.09 Favored 'Trans proline' 0 C--N 1.365 1.428 0 CA-C-N 122.268 1.846 . . . . 0.0 112.205 173.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.655 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER -100.38 46.07 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.257 0.551 . . . . 0.0 110.442 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -101.8 -52.77 3.11 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.256 -176.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 50.9 tpp -131.7 131.46 43.09 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 173.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.976 HG22 ' HG2' ' A' ' 131' ' ' GLU . 36.3 mm -99.79 -109.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.815 -172.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.976 ' HG2' HG22 ' A' ' 130' ' ' ILE . 2.3 pt-20 -110.49 125.55 53.43 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-O 121.662 0.744 . . . . 0.0 112.485 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.75 ' HB2' ' HB3' ' A' ' 135' ' ' ASP . 34.7 mm-40 -71.73 -178.99 2.44 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.505 -1.225 . . . . 0.0 112.103 -178.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.582 ' HD2' ' N ' ' A' ' 134' ' ' SER . 0.0 OUTLIER -54.78 -47.5 73.87 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.11 -176.928 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.582 ' N ' ' HD2' ' A' ' 133' ' ' LYS . 33.0 m -156.91 36.74 0.3 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.219 0.533 . . . . 0.0 109.689 -178.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.75 ' HB3' ' HB2' ' A' ' 132' ' ' GLU . 24.8 t70 -98.85 -46.37 5.67 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.782 HG13 ' HA ' ' A' ' 131' ' ' GLU . 10.6 mm -85.17 139.11 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.259 177.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -147.85 -80.25 0.14 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.78 177.12 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.6 m -156.32 75.12 0.86 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.33 0.586 . . . . 0.0 109.744 176.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 22.5 tp -157.09 145.01 19.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.785 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -99.16 -19.96 16.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.169 0.509 . . . . 0.0 110.725 -175.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.423 HD13 HG21 ' A' ' 141' ' ' ILE . 3.9 pt . . . . . 0 C--O 1.25 1.117 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.942 179.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.478 0.954 0 N-CA-C 110.663 -0.125 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.4 mt 55.36 -91.86 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.77 0.669 . . . . 0.0 111.555 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -120.43 106.16 11.57 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -160.33 26.34 0.16 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.218 0.532 . . . . 0.0 110.771 -172.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -75.71 -67.73 0.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.017 0.437 . . . . 0.0 110.167 178.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.605 ' OG ' ' HD3' ' A' ' 28' ' ' ARG . 12.2 p -165.09 -86.0 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 57.75 80.2 0.18 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 168.231 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.5 -9.44 67.71 Favored Glycine 0 N--CA 1.453 -0.187 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.277 175.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.6 p -97.62 9.68 41.87 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.719 0.771 . . . . 0.0 109.978 -178.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 116.09 -179.88 17.96 Favored Glycine 0 N--CA 1.443 -0.861 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.126 -176.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.406 ' CG1' ' HA2' ' A' ' 27' ' ' GLY . 88.7 t -126.68 99.59 5.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.974 0.416 . . . . 0.0 110.214 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -89.71 -80.94 0.3 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.418 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.406 ' C ' HD23 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -69.75 -16.14 63.26 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.656 0.265 . . . . 0.0 111.267 -177.874 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.712 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 110.32 108.98 3.15 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.926 176.579 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.742 ' O ' ' HB ' ' A' ' 99' ' ' THR . 22.1 mmm180 -68.8 -60.76 2.16 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 121.081 0.467 . . . . 0.0 110.996 172.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.418 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 28.0 p-10 -90.11 156.38 18.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.337 -174.103 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.673 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 9.0 pt20 -90.46 117.26 67.87 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -169.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.601 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.0 Cg_exo -70.18 -163.59 0.12 Allowed 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.959 3.106 . . . . 0.0 112.172 170.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.25 139.01 15.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.857 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.897 ' HZ3' ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -107.47 104.98 14.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.713 -170.057 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.569 ' O ' ' HD3' ' A' ' 34' ' ' LYS . 11.8 tmtt? -99.14 -24.12 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.51 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.601 ' OE1' ' HB3' ' A' ' 102' ' ' HIS . 44.3 mt-10 -71.39 167.4 19.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.524 0.678 . . . . 0.0 112.226 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.461 ' HD2' ' N ' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -105.86 152.9 40.34 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.328 -166.22 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.755 ' HG3' HG23 ' A' ' 106' ' ' THR . 24.8 Cg_exo -62.01 144.88 96.74 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.021 2.481 . . . . 0.0 111.913 177.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.491 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 18.3 ttpp -112.22 115.88 29.53 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -168.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.936 ' HE1' HG12 ' A' ' 120' ' ' VAL . 1.1 p-90 170.71 20.84 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 113.2 -1.818 . . . . 0.0 109.966 173.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.552 ' HD2' ' O ' ' A' ' 41' ' ' SER . 1.6 tmmt? -128.34 147.97 50.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.04 0.448 . . . . 0.0 110.733 -159.563 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.602 ' HG ' ' HG2' ' A' ' 53' ' ' LYS . 58.2 m -64.62 140.31 58.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.571 -175.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.97 -39.36 74.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.678 175.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -140.99 92.22 8.68 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.053 171.1 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.57 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 7.4 Cg_exo -72.42 134.58 22.85 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.477 2.118 . . . . 0.0 110.502 175.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.431 ' HB3' ' H ' ' A' ' 46' ' ' THR . 5.1 ttp -112.66 -86.12 0.57 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.254 -175.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.574 ' HA ' ' CG ' ' A' ' 131' ' ' GLU . 46.4 p -117.67 -173.81 2.5 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.455 ' OD2' ' HD2' ' A' ' 51' ' ' ARG . 16.5 t70 -49.44 -44.87 45.87 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.866 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -53.19 -42.79 63.22 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.286 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.443 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 14.0 mm100 -72.23 -41.96 66.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.722 0.296 . . . . 0.0 110.333 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.75 -57.37 13.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.159 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.455 ' HD2' ' OD2' ' A' ' 47' ' ' ASP . 12.0 ptm180 -63.64 -45.52 89.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.494 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 31.1 t -65.41 -53.79 37.97 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.846 -176.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.602 ' HG2' ' HG ' ' A' ' 41' ' ' SER . 0.5 OUTLIER -65.77 -35.22 80.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.963 -179.363 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.434 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 59.5 ttp180 -56.07 -46.5 78.96 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.435 0.159 . . . . 0.0 110.928 178.781 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.11 -52.7 46.22 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 120.998 0.428 . . . . 0.0 110.678 -177.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -55.76 -49.7 72.4 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.17 -45.27 81.51 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.564 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.434 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -50.14 -36.62 30.73 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.286 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -54.94 -41.02 70.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.724 0.297 . . . . 0.0 111.542 175.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -113.08 10.59 18.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.187 0.518 . . . . 0.0 111.376 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.746 ' O ' ' HB2' ' A' ' 117' ' ' GLN . . . -66.55 -60.18 6.97 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-O 119.085 -0.484 . . . . 0.0 111.047 -177.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.726 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 95.9 Cg_endo -87.05 -9.73 6.11 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 121.876 1.717 . . . . 0.0 111.712 176.362 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 63.46 -103.32 0.11 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.626 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -109.52 -8.62 14.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.934 -177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 56.42 -112.23 0.68 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -166.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.91 -99.72 0.24 Allowed Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 119.513 -1.327 . . . . 0.0 113.824 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.604 ' HD3' ' OD2' ' A' ' 110' ' ' ASP . 7.8 ttt180 -99.5 113.81 26.41 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 122.894 0.478 . . . . 0.0 109.758 -173.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.423 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 72.9 mmtt -75.64 -26.65 57.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -58.09 -37.16 73.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.168 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.669 HD11 HG12 ' A' ' 98' ' ' ILE . 0.8 OUTLIER -82.97 -22.01 8.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.553 -179.41 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.565 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -47.28 -41.73 19.44 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -172.83 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.581 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 11.9 m-20 -56.44 -31.29 63.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.08 -33.13 50.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.024 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.526 HD22 HD13 ' A' ' 70' ' ' ILE . 26.3 mt -70.55 -45.45 65.42 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.527 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.581 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 14.1 ptpt -68.9 -33.08 73.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.776 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -67.32 -36.05 80.67 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.954 0.407 . . . . 0.0 110.659 176.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.655 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -69.92 -48.99 56.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.708 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.466 ' HA ' HD12 ' A' ' 105' ' ' LEU . . . -52.6 -33.96 48.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.503 173.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 29.5 t60 -65.95 -51.36 59.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.509 -179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.14 -46.7 82.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.676 177.622 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -59.43 -33.61 71.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.241 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.46 -38.44 84.21 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.304 0.573 . . . . 0.0 110.823 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.423 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 22.7 t -85.72 21.31 1.9 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.322 -177.316 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.423 ' HB2' ' O ' ' A' ' 83' ' ' SER . 16.5 m120 73.82 0.43 3.63 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.838 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.641 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 14.8 m-20 -79.07 83.31 5.16 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.687 0.756 . . . . 0.0 110.314 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 58.6 m80 -71.9 -40.59 68.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.28 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.672 ' HA ' HE21 ' A' ' 90' ' ' GLN . 5.3 pt-20 -74.46 -31.52 62.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.26 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.641 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 10.1 mt -58.87 -51.55 69.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.174 0.511 . . . . 0.0 110.204 173.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.548 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -62.41 -44.23 96.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.001 -175.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.672 HE21 ' HA ' ' A' ' 87' ' ' GLU . 26.2 pt20 -66.88 -33.31 75.32 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.729 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.23 -26.24 61.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.855 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.484 HG13 ' O ' ' A' ' 88' ' ' LEU . 51.1 mt -74.15 -55.12 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 177.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.577 ' CG2' HG22 ' A' ' 98' ' ' ILE . 8.8 mm -52.18 -59.18 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.551 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.86 -27.26 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.709 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.78 -20.52 66.43 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.531 -0.758 . . . . 0.0 113.098 -177.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.529 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -84.48 -53.22 5.58 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.136 0.468 . . . . 0.0 110.21 179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.529 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.4 t-20 152.29 -28.29 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -175.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.994 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -57.66 145.38 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 112.44 -2.163 . . . . 0.0 111.734 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.742 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 33.7 p -132.74 165.47 24.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.568 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.86 HD21 ' HD2' ' A' ' 101' ' ' PRO . 2.3 tm? -150.84 113.51 3.16 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 173.053 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.86 ' HD2' HD21 ' A' ' 100' ' ' LEU . 13.2 Cg_endo -55.68 -42.14 70.47 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 124.012 3.141 . . . . 0.0 114.759 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.601 ' HB3' ' OE1' ' A' ' 35' ' ' GLU . 5.4 m-70 -72.66 -21.25 61.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -176.562 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.601 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 86.15 17.12 61.55 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.933 -173.499 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -93.6 143.56 26.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.064 0.459 . . . . 0.0 110.971 -175.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.699 ' HB2' ' HG3' ' A' ' 33' ' ' LYS . 3.0 tm? -78.49 -32.03 48.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.779 -178.113 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.755 HG23 ' HG3' ' A' ' 37' ' ' PRO . 53.3 p -84.47 16.83 2.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.549 -172.458 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.601 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 41.1 mt-10 -148.5 140.95 24.28 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.091 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 76.8 m -152.19 145.14 24.45 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -118.67 122.8 43.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.994 ' HA ' HG13 ' A' ' 98' ' ' ILE . 12.6 t70 -80.92 148.41 29.87 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.236 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -57.5 -24.31 55.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.797 -1.092 . . . . 0.0 112.331 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.431 HD12 ' HD2' ' A' ' 67' ' ' ARG . 27.7 mt -79.23 -5.07 53.5 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.928 0.394 . . . . 0.0 110.949 -178.625 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.43 29.85 6.49 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.154 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.753 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 17.1 m120 -101.52 158.23 16.23 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.91 -0.171 . . . . 0.0 110.764 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -129.45 129.71 44.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.368 0.604 . . . . 0.0 110.762 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . 0.505 ' HE2' ' NE1' ' A' ' 71' ' ' TRP . 17.3 m-85 -117.71 128.44 54.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.869 177.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.746 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 3.8 mm100 -123.21 127.23 48.33 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.485 HD21 HG22 ' A' ' 106' ' ' THR . 36.1 tp -98.75 124.24 46.73 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.385 -171.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.643 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 12.3 Cg_exo -72.82 155.04 53.93 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.33 2.687 . . . . 0.0 112.777 177.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.936 HG12 ' HE1' ' A' ' 39' ' ' TRP . 0.3 OUTLIER -76.45 -20.38 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 114.901 -1.045 . . . . 0.0 112.515 -171.244 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 0.643 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -57.08 -30.09 64.03 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.147 -171.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 46.9 t -94.51 -6.53 43.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.302 -173.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.502 HD12 ' HG3' ' A' ' 37' ' ' PRO . 94.6 mt -118.63 -54.12 2.28 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -175.492 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -117.67 111.75 39.33 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.154 0.502 . . . . 0.0 111.929 -172.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.37 -39.53 45.94 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 123.745 2.964 . . . . 0.0 115.862 176.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -42.69 -59.12 1.04 Allowed 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.658 2.239 . . . . 0.0 114.507 -175.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.774 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER -85.59 18.05 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.894 0.378 . . . . 0.0 111.746 -176.609 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -107.39 -18.38 13.88 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 172.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 44.5 ttm -102.77 -54.04 2.73 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.935 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.625 ' HB ' ' OE2' ' A' ' 131' ' ' GLU . 18.3 mt 66.75 -79.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 O-C-N 124.059 0.849 . . . . 0.0 112.178 176.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.732 ' HB2' HG13 ' A' ' 136' ' ' ILE . 2.3 mp0 -61.13 138.25 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.561 0.538 . . . . 0.0 110.315 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -87.63 -169.55 2.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.031 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -77.5 74.42 4.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.561 0.696 . . . . 0.0 111.253 -172.216 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.5 p -108.04 -75.83 0.62 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.0 169.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -98.52 -30.11 12.7 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.223 173.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.732 HG13 ' HB2' ' A' ' 131' ' ' GLU . 29.2 mm -62.12 158.53 3.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.644 -177.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -117.52 123.18 45.66 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -176.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.0 m -68.39 100.08 1.03 Allowed 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.475 175.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 9.6 mp -79.41 167.85 20.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.91 0.386 . . . . 0.0 110.955 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -122.78 21.22 10.03 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.402 HG21 HD12 ' A' ' 141' ' ' ILE . 8.0 pt . . . . . 0 C--O 1.25 1.091 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.552 177.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.5 m . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 120.606 0.241 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 64.74 36.21 8.26 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.966 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.509 ' ND2' ' HG3' ' A' ' 17' ' ' GLU . 16.6 t30 -149.7 135.92 18.96 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.918 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.509 ' HG3' ' ND2' ' A' ' 16' ' ' ASN . 54.4 mt-10 63.59 59.17 1.22 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.264 0.554 . . . . 0.0 110.41 -177.278 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -76.93 132.5 39.1 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.744 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 t 61.33 -87.42 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.046 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -84.6 -17.57 38.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.781 0.324 . . . . 0.0 111.231 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.54 -47.32 3.81 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.427 178.59 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.0 t -66.36 -18.65 65.48 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.04 0.448 . . . . 0.0 110.826 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.84 -147.15 4.48 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 176.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.428 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 4.9 p -92.38 -31.62 4.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 174.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.428 ' HB3' ' O ' ' A' ' 24' ' ' VAL . . . 167.55 -94.16 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.5 1.12 . . . . 0.0 107.982 172.725 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -126.57 -3.99 6.61 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.142 175.021 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.607 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 120.19 45.52 0.4 Allowed Glycine 0 N--CA 1.443 -0.855 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.559 -175.508 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.588 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.0 ppt_? -64.32 -32.34 73.9 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.238 -173.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.705 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -93.39 156.73 16.61 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 171.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.4 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.9 OUTLIER -81.12 104.21 2.64 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -158.927 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.903 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 92.5 Cg_endo -78.87 -162.46 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 123.733 2.955 . . . . 0.0 111.839 172.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.542 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.1 mp -49.01 144.68 4.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.308 0.575 . . . . 0.0 112.044 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.531 ' HD2' ' N ' ' A' ' 33' ' ' LYS . 8.6 mptt -84.85 83.29 8.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.313 -178.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -97.68 -18.33 18.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.936 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.958 ' HB3' ' HB1' ' A' ' 104' ' ' ALA . 9.2 tp10 -87.16 159.73 18.77 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.223 0.535 . . . . 0.0 110.451 -177.711 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.469 ' HG2' ' OE2' ' A' ' 35' ' ' GLU . 16.6 pttm -99.99 155.13 36.79 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.109 -173.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.692 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 5.1 Cg_exo -73.97 143.28 32.57 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.302 2.001 . . . . 0.0 111.514 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.751 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 23.5 ttpp -110.88 145.69 37.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.225 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 1.038 ' HE1' HG23 ' A' ' 120' ' ' VAL . 0.9 OUTLIER 134.43 -3.68 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 O-C-N 125.227 1.579 . . . . 0.0 109.844 -172.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -113.48 158.73 20.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -167.199 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.455 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 25.0 m -65.23 125.26 24.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.524 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -61.91 -26.35 68.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.407 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -146.0 88.95 6.19 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.395 173.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.455 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 6.4 Cg_exo -75.4 137.34 20.72 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.924 2.416 . . . . 0.0 111.273 176.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.529 ' HE1' ' HG3' ' A' ' 49' ' ' GLN . 64.1 mtm -114.66 -75.39 0.59 Allowed 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -177.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.803 ' HA ' ' HG2' ' A' ' 131' ' ' GLU . 78.3 p -115.54 175.68 5.41 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.474 -0.491 . . . . 0.0 111.323 -178.694 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.01 -41.89 97.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.015 0.436 . . . . 0.0 110.077 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.81 -44.3 87.07 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.697 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.529 ' HG3' ' HE1' ' A' ' 45' ' ' MET . 83.5 mm-40 -68.67 -45.07 72.69 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 176.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -54.92 -47.47 74.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.797 -177.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.0 ptm180 -73.42 -39.44 65.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.604 0.24 . . . . 0.0 111.477 -176.657 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 m -68.82 -42.18 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.456 ' HA ' ' HD3' ' A' ' 53' ' ' LYS . 60.1 mmtt -71.58 -32.57 68.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.055 177.196 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -53.2 -48.46 68.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.088 0.471 . . . . 0.0 110.041 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.35 -52.58 64.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.99 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.79 -49.34 75.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.722 -1.127 . . . . 0.0 111.734 -177.048 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.403 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 42.6 m-85 -70.36 -37.16 74.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.744 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.403 ' HZ3' ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -54.18 -37.56 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 177.709 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -66.74 -20.29 65.93 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.826 0.346 . . . . 0.0 111.784 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 15.4 m -95.08 -11.87 27.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 109.659 178.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.451 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -86.0 158.23 56.12 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.424 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.451 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 19.3 Cg_endo -85.2 -10.57 7.85 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.016 2.478 . . . . 0.0 113.749 -170.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.403 ' HA ' ' HZ3' ' A' ' 58' ' ' TRP . . . 54.61 -111.12 0.6 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.446 179.269 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -108.57 -1.49 19.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.888 0.375 . . . . 0.0 110.893 -176.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -76.31 151.71 36.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.833 -172.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.417 ' HA2' ' CE1' ' A' ' 116' ' ' TYR . . . 136.47 179.01 16.24 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.922 -178.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.637 ' O ' HG21 ' A' ' 70' ' ' ILE . 2.7 mmp_? -63.66 80.89 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 171.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.469 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 13.5 tptm -49.62 -37.82 29.5 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.897 0.479 . . . . 0.0 112.119 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.41 -40.74 62.51 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.186 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.637 HG21 ' O ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -84.32 -23.81 7.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.9 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.636 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -53.0 -38.49 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.259 -173.316 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.601 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 18.4 m-20 -62.49 -28.67 69.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.25 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.95 -27.58 39.75 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.519 0.676 . . . . 0.0 109.551 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.714 HD12 ' SG ' ' A' ' 108' ' ' CYS . 27.7 mt -74.71 -43.55 54.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.527 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.636 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.1 ptpt -70.53 -29.83 66.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.61 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.42 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.97 -38.29 72.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.767 175.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.442 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -65.64 -44.24 87.03 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.357 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.519 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -48.45 -41.14 28.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.694 170.576 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.42 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 29.7 t60 -62.26 -48.94 77.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.329 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -62.5 -53.03 60.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.622 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.5 ' HD2' HD21 ' A' ' 123' ' ' LEU . 20.6 t80 -55.47 -39.34 70.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.526 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.519 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.3 mt-10 -61.1 -33.75 73.87 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.433 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 8.1 t -87.57 20.11 3.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.159 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.433 ' HB2' ' O ' ' A' ' 83' ' ' SER . 3.4 m-20 73.44 4.8 4.89 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.751 0.82 . . . . 0.0 111.599 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.835 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 54.0 m-20 -82.35 84.1 7.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.825 0.821 . . . . 0.0 110.966 -179.476 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.542 ' NE2' ' HA ' ' A' ' 32' ' ' LEU . 8.0 t-80 -69.03 -42.3 76.56 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.113 177.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.33 -33.75 71.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.146 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.835 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 7.0 mp -65.32 -56.32 13.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.975 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.614 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.67 -41.11 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.508 -176.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -69.35 -30.35 68.36 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.018 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.63 -21.99 51.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.938 0.399 . . . . 0.0 110.762 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 52.9 mt -77.93 -56.84 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.538 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 89' ' ' ALA . 10.1 mm -50.52 -60.67 0.79 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.122 176.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.02 -24.96 66.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.1 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.38 -16.74 73.78 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.859 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -97.99 5.59 48.64 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 122.718 -0.284 . . . . 0.0 110.893 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.6 t30 78.14 0.65 2.71 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.724 0.773 . . . . 0.0 109.76 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.933 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -89.71 144.92 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.426 177.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.588 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 22.7 p -140.62 171.1 14.58 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.456 -177.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.494 HD13 ' H ' ' A' ' 104' ' ' ALA . 1.6 tm? -148.59 103.36 3.46 Favored Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.13 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.607 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 21.2 Cg_endo -60.7 -25.13 80.38 Favored 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.763 2.975 . . . . 0.0 114.094 -174.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.405 ' HB2' ' CD1' ' A' ' 100' ' ' LEU . 90.8 m-70 -76.26 -13.08 60.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.889 0.375 . . . . 0.0 110.402 177.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.903 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 77.32 9.18 86.97 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.652 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.958 ' HB1' ' HB3' ' A' ' 35' ' ' GLU . . . -94.47 142.82 26.99 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.65 0.738 . . . . 0.0 111.612 -174.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.53 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.5 tm? -78.64 -14.23 59.42 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.225 -1.352 . . . . 0.0 107.792 173.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.692 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 25.4 p -84.24 6.85 21.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.153 -175.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.472 ' HB3' HD22 ' A' ' 100' ' ' LEU . 40.2 mt-10 -145.06 161.1 40.27 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.714 ' SG ' HD12 ' A' ' 74' ' ' LEU . 3.9 p -155.53 133.03 11.06 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.79 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.482 ' HA ' ' O ' ' A' ' 114' ' ' ASN . 19.4 m-30 -118.75 121.32 39.81 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.568 0.699 . . . . 0.0 109.573 177.148 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.933 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -87.29 152.27 22.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.773 -174.334 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.07 -25.47 63.79 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.854 -1.067 . . . . 0.0 112.645 -169.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.9 mt -79.05 -11.53 60.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.553 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.72 31.19 3.75 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.057 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.884 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 43.7 m-80 -96.11 145.09 25.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.689 0.281 . . . . 0.0 111.179 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.462 ' HG3' ' O ' ' A' ' 115' ' ' ARG . 18.6 ptt180 -123.94 128.4 49.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.647 175.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . 0.679 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 35.3 m-85 -128.25 148.04 50.62 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 176.214 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.4 ' O ' ' HG3' ' A' ' 62' ' ' PRO . 9.3 mm100 -121.3 120.89 36.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.425 -173.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.699 HD12 ' HD2' ' A' ' 119' ' ' PRO . 13.9 tp -96.57 117.07 66.33 Favored Pre-proline 0 C--N 1.316 -0.868 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.584 -172.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.765 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 35.1 Cg_exo -62.51 154.99 60.87 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.821 3.014 . . . . 0.0 113.744 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 1.038 HG23 ' HE1' ' A' ' 39' ' ' TRP . 3.7 m -68.84 -16.49 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.223 -174.655 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 0.765 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.1 p90 -61.26 -18.28 57.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -169.879 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.5 t -121.06 14.54 11.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.059 -176.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.594 ' CD1' HG22 ' A' ' 106' ' ' THR . 95.8 mt -140.77 -52.22 0.47 Allowed 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.898 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.501 ' HB1' ' HB ' ' A' ' 120' ' ' VAL . . . -109.85 156.45 39.85 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.621 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.557 ' CB ' ' HD2' ' A' ' 126' ' ' PRO . 74.1 Cg_exo -53.3 -168.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.269 0 C-N-CA 123.618 2.879 . . . . 0.0 112.158 170.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.557 ' HD2' ' CB ' ' A' ' 125' ' ' PRO . 82.8 Cg_endo -69.74 13.51 0.28 Allowed 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.041 1.827 . . . . 0.0 112.654 -178.329 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.489 ' H ' ' C ' ' A' ' 125' ' ' PRO . 42.5 mm 68.4 -42.8 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.482 ' O ' HG13 ' A' ' 130' ' ' ILE . 49.9 t30 -153.01 149.01 27.73 Favored 'General case' 0 N--CA 1.419 -2.007 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 -177.506 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' MET . . . . . 0.714 ' SD ' ' HA ' ' A' ' 134' ' ' SER . 52.3 ttm -64.62 -17.26 63.84 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 121.51 0.672 . . . . 0.0 109.557 175.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 128' ' ' ASN . 45.4 mt 71.91 -86.07 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.741 170.964 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.803 ' HG2' ' HA ' ' A' ' 46' ' ' THR . 29.1 mt-10 -79.78 143.98 33.97 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 121.044 0.45 . . . . 0.0 110.696 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -67.13 -178.99 0.88 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.82 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.525 ' HE3' ' HB2' ' A' ' 135' ' ' ASP . 21.5 ttpp 71.26 -1.39 2.75 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.572 175.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.714 ' HA ' ' SD ' ' A' ' 129' ' ' MET . 19.7 m 59.29 41.72 19.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.518 -178.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . 0.525 ' HB2' ' HE3' ' A' ' 133' ' ' LYS . 15.1 t70 -86.7 -37.57 17.82 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -176.317 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 15.6 mm -82.21 136.06 23.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.446 173.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 50.04 70.28 0.52 Allowed 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.704 0.627 . . . . 0.0 109.922 -173.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 5.6 m -75.31 76.51 2.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.15 -174.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 20.9 tp -98.22 119.27 36.58 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.542 175.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -90.86 -36.03 14.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.565 0.698 . . . . 0.0 109.74 -177.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.406 HD11 HG21 ' A' ' 141' ' ' ILE . 2.7 pt . . . . . 0 C--O 1.248 0.975 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.966 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.5 p . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 120.619 0.247 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -99.26 94.48 6.49 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.495 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 3.5 t-20 -143.73 130.66 20.48 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.604 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.495 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 17.9 mm-40 75.81 129.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 124.422 1.076 . . . . 0.0 111.825 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -117.28 -177.34 3.2 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.196 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.408 ' HB3' ' HA ' ' A' ' 26' ' ' LEU . 10.2 t -146.98 47.12 1.16 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.393 178.25 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -77.86 162.06 27.14 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.283 -178.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.26 -46.23 3.17 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.738 -177.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.1 t -101.89 11.38 38.7 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.296 0.57 . . . . 0.0 109.807 175.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.2 -173.67 39.06 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.846 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.414 HG11 ' CZ ' ' A' ' 28' ' ' ARG . 32.9 m -78.31 -31.25 16.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.519 0.676 . . . . 0.0 111.11 -177.458 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 179.56 -39.59 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 -174.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.642 ' H ' HD12 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -121.02 -165.17 1.19 Allowed 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 114.032 -1.44 . . . . 0.0 107.457 165.6 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.777 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . -100.69 78.81 0.43 Allowed Glycine 0 C--N 1.309 -0.935 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.131 -173.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.694 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.9 mmt85 -33.96 -62.87 0.29 Allowed 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 123.511 0.724 . . . . 0.0 112.778 174.305 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.606 ' HB2' ' OD2' ' A' ' 94' ' ' ASP . 3.3 p-10 -89.87 156.84 18.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.498 -175.092 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -84.52 109.76 22.22 Favored Pre-proline 0 C--N 1.325 -0.5 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -166.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.775 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 88.1 Cg_endo -79.1 -164.92 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.702 2.935 . . . . 0.0 111.467 169.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.04 149.24 19.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.385 0.612 . . . . 0.0 112.114 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.639 ' N ' ' HE2' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -75.69 102.52 5.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.047 -172.436 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -97.29 -20.87 17.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.475 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.573 ' HB2' ' HB2' ' A' ' 104' ' ' ALA . 47.1 mt-10 -103.28 171.86 7.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.03 0.919 . . . . 0.0 113.266 -172.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.605 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 26.7 pttt -106.84 160.29 26.83 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 113.27 -1.786 . . . . 0.0 109.409 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.847 ' HG2' HG12 ' A' ' 120' ' ' VAL . 10.6 Cg_endo -61.58 139.29 80.63 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.266 1.977 . . . . 0.0 112.557 172.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.668 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 2.7 mtmt -112.14 147.81 35.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.198 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.981 ' HE1' HG23 ' A' ' 120' ' ' VAL . 1.9 p-90 132.27 -16.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.616 1.967 . . . . 0.0 108.289 -175.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.744 ' HZ1' HD21 ' A' ' 50' ' ' LEU . 10.1 tppt? -113.45 153.69 28.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.365 -174.12 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.452 ' HG ' ' HG3' ' A' ' 53' ' ' LYS . 48.9 m -65.49 135.02 54.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.265 -177.723 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -72.08 -27.34 62.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.69 175.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -131.78 81.99 61.67 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.108 170.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.43 130.11 16.83 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.603 2.202 . . . . 0.0 111.053 177.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.516 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.0 mtp -102.1 -87.64 0.4 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -174.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.548 ' HA ' ' HG2' ' A' ' 131' ' ' GLU . 69.1 p -118.78 179.09 4.24 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.365 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.517 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.7 t70 -54.66 -48.04 72.82 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.16 -35.15 82.98 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.232 -0.508 . . . . 0.0 112.608 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.686 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 31.3 mm-40 -70.13 -51.55 30.61 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 175.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.744 HD21 ' HZ1' ' A' ' 40' ' ' LYS . 3.2 tm? -55.94 -47.97 76.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.808 -177.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.661 ' HG3' ' N ' ' A' ' 52' ' ' SER . 13.6 ptp180 -62.9 -48.94 76.78 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.235 0.334 . . . . 0.0 111.586 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.661 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 24.3 t -68.46 -47.2 67.75 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -176.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.686 ' HB2' ' O ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -55.11 -44.45 74.99 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.512 173.897 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.422 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 62.0 ttt180 -60.77 -53.04 62.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.305 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.05 -49.93 74.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.77 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -51.97 -49.49 63.13 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.364 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.589 ' CD1' ' HA ' ' A' ' 39' ' ' TRP . 3.6 t80 -75.25 -38.91 60.3 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.581 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.503 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -53.99 -33.47 57.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.755 0.312 . . . . 0.0 111.338 -179.727 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.48 -25.85 68.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 0.0 111.566 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -109.13 -30.45 8.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.807 -172.048 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.64 ' HB1' ' HD3' ' A' ' 62' ' ' PRO . . . -49.49 -56.92 13.7 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -174.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.64 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 43.5 Cg_endo -89.26 -9.8 4.18 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.19 1.927 . . . . 0.0 113.042 -177.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.9 38.0 0.73 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -170.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -106.06 -8.76 17.34 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 66.24 150.84 0.05 Allowed 'General case' 0 N--CA 1.463 0.206 0 O-C-N 124.266 0.979 . . . . 0.0 112.094 -177.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.713 ' HA2' ' HB3' ' A' ' 114' ' ' ASN . . . -168.96 -123.53 0.68 Allowed Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.47 -177.311 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.522 ' H ' ' HE2' ' A' ' 116' ' ' TYR . 7.3 ttt85 -159.85 133.41 7.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.85 0.357 . . . . 0.0 110.185 -175.079 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 71' ' ' TRP . 75.4 mmtt -77.66 -25.64 49.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.12 -175.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -57.9 -52.91 63.56 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.315 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.58 HD11 HG12 ' A' ' 98' ' ' ILE . 0.1 OUTLIER -68.37 -23.13 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.71 -178.499 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.531 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 1.8 m95 -50.99 -34.33 28.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 111.481 -178.324 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.745 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 17.2 t70 -56.89 -39.87 75.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.829 177.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.74 -27.08 60.99 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.227 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.676 HD12 ' SG ' ' A' ' 108' ' ' CYS . 24.6 mt -68.92 -43.65 74.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 72' ' ' ASP . 8.4 mtmt -64.95 -46.3 82.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -57.74 -43.93 85.71 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.669 178.641 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.717 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -68.01 -52.31 37.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.725 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.499 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -50.0 -35.28 24.0 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 123.451 0.469 . . . . 0.0 110.462 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.488 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 21.4 t60 -60.68 -52.24 65.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.28 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.549 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -67.68 -52.53 36.84 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.705 177.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -51.31 -36.12 41.12 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.782 178.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.499 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -57.49 -39.22 75.99 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.183 0.516 . . . . 0.0 111.138 175.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.5 t -87.63 23.72 1.89 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.214 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 71.89 5.2 5.28 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.072 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.549 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 8.8 t0 -79.58 89.63 5.1 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.491 0.662 . . . . 0.0 110.418 -178.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 56.8 m80 -70.74 -35.82 72.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.008 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.519 ' HA ' HE21 ' A' ' 90' ' ' GLN . 9.4 pt-20 -70.22 -44.39 68.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.833 -170.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.449 ' O ' HG13 ' A' ' 92' ' ' ILE . 13.3 mt -60.65 -54.42 45.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.819 0.342 . . . . 0.0 111.316 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.488 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.71 -42.87 94.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.908 -174.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.519 HE21 ' HA ' ' A' ' 87' ' ' GLU . 25.8 pt20 -70.57 -32.89 70.46 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.68 -24.21 49.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.449 HG13 ' O ' ' A' ' 88' ' ' LEU . 41.2 mt -72.26 -57.7 6.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.391 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.516 ' CG2' HG22 ' A' ' 98' ' ' ILE . 9.6 mm -50.0 -57.49 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.839 174.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . 0.606 ' OD2' ' HB2' ' A' ' 29' ' ' ASN . 3.9 t70 -64.4 -31.53 72.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.852 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -74.36 -10.21 81.88 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.391 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.5 -0.68 51.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.681 -0.305 . . . . 0.0 110.415 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 74.73 7.86 4.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 122.024 0.916 . . . . 0.0 109.071 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.939 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -87.38 137.09 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 114.455 -1.248 . . . . 0.0 108.74 172.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.694 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 40.1 p -120.37 166.09 14.01 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.218 -175.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.561 HD21 ' HD2' ' A' ' 101' ' ' PRO . 1.6 tm? -149.47 101.44 3.3 Favored Pre-proline 0 N--CA 1.446 -0.658 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.666 176.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.777 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 26.4 Cg_endo -61.39 -16.79 49.43 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.801 3.001 . . . . 0.0 113.871 -172.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.529 ' HB2' ' CD1' ' A' ' 100' ' ' LEU . 56.3 m-70 -82.83 -18.69 39.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.06 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.775 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 80.01 9.98 86.08 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.98 -0.628 . . . . 0.0 112.386 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.573 ' HB2' ' HB2' ' A' ' 35' ' ' GLU . . . -98.84 148.2 24.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.259 0.552 . . . . 0.0 111.776 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.717 HD22 ' HB1' ' A' ' 77' ' ' ALA . 2.6 tm? -79.15 -17.67 54.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 174.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.904 HG22 HD11 ' A' ' 123' ' ' LEU . 52.4 p -87.57 21.18 2.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.019 -171.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.541 ' HB3' HD22 ' A' ' 100' ' ' LEU . 49.1 mt-10 -157.12 160.37 38.77 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.677 ' SG ' ' HB2' ' A' ' 116' ' ' TYR . 13.3 p -154.8 139.37 16.92 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.318 174.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.452 ' HD1' ' O ' ' A' ' 108' ' ' CYS . 11.8 m-30 -118.52 120.86 38.78 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.698 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.972 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 5.0 t70 -80.69 145.23 31.7 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.674 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -60.01 -22.28 62.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.868 -170.384 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.18 28.65 4.31 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.311 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.972 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 60.7 m-80 -98.97 158.65 15.51 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.984 -0.127 . . . . 0.0 110.796 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -139.34 139.65 37.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.331 . . . . 0.0 111.467 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . 0.677 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 27.6 m-85 -136.67 152.75 50.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.113 175.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.468 ' O ' ' HD3' ' A' ' 119' ' ' PRO . 10.2 mm100 -122.05 120.83 35.49 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.002 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.624 ' HB2' ' C ' ' A' ' 106' ' ' THR . 4.1 mm? -90.06 109.79 35.55 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-O 121.143 0.497 . . . . 0.0 111.512 -176.151 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.542 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 22.1 Cg_exo -74.74 156.09 44.18 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 124.152 3.235 . . . . 0.0 113.633 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.981 HG23 ' HE1' ' A' ' 39' ' ' TRP . 4.9 m -63.63 -16.68 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.735 -1.12 . . . . 0.0 113.178 -173.096 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 0.542 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.2 p90 -58.35 -23.54 57.14 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -169.618 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 39.4 t -129.84 27.35 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.096 0.474 . . . . 0.0 109.877 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.904 HD11 HG22 ' A' ' 106' ' ' THR . 95.1 mt -138.27 -50.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.917 -176.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -135.08 111.5 11.03 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 120.962 0.41 . . . . 0.0 111.833 -175.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.653 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 31.6 Cg_exo -61.51 -43.57 26.8 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.545 2.83 . . . . 0.0 115.271 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.653 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 16.3 Cg_exo -29.68 -56.87 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 124.866 3.711 . . . . 0.0 115.63 -174.142 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.85 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER -78.38 50.1 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.111 0.481 . . . . 0.0 111.853 -176.041 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -94.89 -61.38 1.5 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.561 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -81.93 -37.12 27.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -175.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 2.9 mp 66.78 -70.91 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 C-N-CA 123.093 0.557 . . . . 0.0 110.704 -174.159 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.732 ' HB2' HG13 ' A' ' 136' ' ' ILE . 28.2 mt-10 -74.85 165.7 24.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.932 0.396 . . . . 0.0 110.032 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.414 ' HB2' ' H ' ' A' ' 133' ' ' LYS . 12.3 pt-20 -124.38 -151.6 0.48 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -169.754 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.414 ' H ' ' HB2' ' A' ' 132' ' ' GLU . 16.4 ptmt 57.7 12.13 1.52 Allowed 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.347 1.459 . . . . 0.0 113.779 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.3 m 54.11 39.52 30.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.542 175.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -110.57 -36.41 5.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.257 0.551 . . . . 0.0 110.988 -177.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.732 HG13 ' HB2' ' A' ' 131' ' ' GLU . 22.1 mm -73.14 -98.18 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.769 -171.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.501 ' HG2' HG22 ' A' ' 136' ' ' ILE . 8.4 mm-40 -90.67 49.04 1.61 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.0 0.429 . . . . 0.0 111.319 -176.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.5 m -97.82 62.67 1.63 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.67 0.747 . . . . 0.0 109.984 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 21.7 tp -128.36 103.72 7.31 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.129 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -108.26 -46.12 3.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.555 -171.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 22.1 pt . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.85 -179.02 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.8 m . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.961 0.41 . . . . 0.0 110.294 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 95.8 mt -120.37 104.63 10.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.1 0.476 . . . . 0.0 110.84 -178.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -92.25 65.58 4.65 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -85.5 -60.84 1.91 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.204 -170.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.415 ' C ' ' H ' ' A' ' 20' ' ' GLU . 31.6 p30 -78.91 -156.1 0.1 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -174.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.8 m -73.64 21.6 0.08 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -176.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' A' ' 18' ' ' ASN . 31.6 tt0 -131.24 87.62 2.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.021 0.438 . . . . 0.0 110.596 175.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -115.85 -2.18 20.73 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.364 -0.695 . . . . 0.0 111.364 175.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.8 t -168.68 48.9 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.781 0.8 . . . . 0.0 109.596 -177.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.8 -62.11 3.36 Favored Glycine 0 N--CA 1.451 -0.332 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 -171.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.969 HG11 ' HG2' ' A' ' 28' ' ' ARG . 10.4 t -120.85 -137.41 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 167.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.547 ' H ' ' CG1' ' A' ' 24' ' ' VAL . . . -148.04 -76.97 0.17 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.854 HD21 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -106.54 -21.98 12.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.599 177.887 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.43 ' H ' HD11 ' A' ' 26' ' ' LEU . . . 139.41 111.75 0.98 Allowed Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.383 175.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.969 ' HG2' HG11 ' A' ' 24' ' ' VAL . 24.1 mmt180 -56.87 -73.32 0.07 Allowed 'General case' 0 C--O 1.233 0.214 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 172.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.529 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 31.0 p-10 -99.31 159.61 14.88 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.851 -172.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.589 ' HG2' ' HZ3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -84.37 110.27 25.52 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.229 -165.149 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.552 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.6 Cg_exo -70.75 -162.91 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 124.056 3.171 . . . . 0.0 112.666 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.632 HD13 ' H ' ' A' ' 32' ' ' LEU . 6.5 mp -41.52 139.25 1.15 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.408 0.683 . . . . 0.0 112.798 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.962 ' HE2' ' HG2' ' A' ' 90' ' ' GLN . 2.3 mptp? -89.8 74.45 7.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.629 -176.039 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.92 -15.4 19.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.446 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.9 tt0 -77.03 156.91 31.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.491 0.662 . . . . 0.0 111.008 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.5 pttt -94.97 159.23 33.57 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.038 -172.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.504 ' HB2' ' CG1' ' A' ' 120' ' ' VAL . 12.2 Cg_exo -68.86 144.83 60.34 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.055 1.837 . . . . 0.0 111.296 174.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.764 ' HZ2' ' NE2' ' A' ' 117' ' ' GLN . 31.9 ttpt -111.04 145.19 38.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.303 -170.957 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 1.01 ' HE1' HG23 ' A' ' 120' ' ' VAL . 1.0 OUTLIER 134.75 -9.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 O-C-N 125.429 1.706 . . . . 0.0 109.775 -179.348 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.777 ' HG2' HG11 ' A' ' 120' ' ' VAL . 0.0 OUTLIER -113.61 168.89 9.38 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.386 0.612 . . . . 0.0 111.396 -171.049 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.404 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 19.2 m -85.82 133.13 33.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.287 -176.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.3 -27.85 66.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.444 0.64 . . . . 0.0 109.338 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -141.43 84.4 12.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.892 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.404 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 16.3 Cg_exo -68.49 144.36 60.83 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.825 2.35 . . . . 0.0 111.805 -178.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.581 ' O ' HG22 ' A' ' 130' ' ' ILE . 0.0 OUTLIER -127.21 -135.25 0.24 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.279 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.811 HG23 HD11 ' A' ' 136' ' ' ILE . 69.0 p -73.1 170.05 15.73 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -171.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.463 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 20.4 t70 -55.15 -37.88 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.617 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.44 -36.59 63.97 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.109 177.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -75.42 -39.16 59.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.725 ' HB2' HG23 ' A' ' 130' ' ' ILE . 54.8 tp -58.66 -53.18 61.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.903 178.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 16.4 ptp180 -60.72 -46.83 88.9 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.082 -178.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 18.2 m -65.2 -47.66 76.14 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.947 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.601 ' C ' ' HD2' ' A' ' 53' ' ' LYS . 4.5 tmmm? -56.95 -45.75 82.59 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.135 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -53.5 -53.47 50.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.429 -174.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.1 -50.4 48.48 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.051 0.453 . . . . 0.0 111.147 -177.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.473 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 1.7 tm-20 -54.56 -49.87 69.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.836 -177.549 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.401 ' CE1' ' HG2' ' A' ' 53' ' ' LYS . 12.1 m-85 -71.48 -39.05 71.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.622 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.488 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 1.9 m95 -56.91 -23.08 42.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . 0.473 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 7.5 t70 -65.9 -37.24 85.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.858 0.361 . . . . 0.0 111.351 173.519 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.2 m -107.91 -22.08 12.58 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -169.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.584 ' HB1' ' HD3' ' A' ' 62' ' ' PRO . . . -60.46 -59.19 14.63 Favored Pre-proline 0 CA--C 1.538 0.512 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.584 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 88.0 Cg_endo -78.41 -8.06 16.07 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.073 1.849 . . . . 0.0 112.953 -174.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 67.17 -150.79 0.18 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.166 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -88.37 -43.38 11.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.04 0.448 . . . . 0.0 110.41 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -179.19 -175.87 0.39 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.072 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.437 ' HA3' ' CZ ' ' A' ' 116' ' ' TYR . . . -162.81 -168.52 24.87 Favored Glycine 0 N--CA 1.44 -1.073 0 N-CA-C 111.421 -0.672 . . . . 0.0 111.421 175.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.534 ' O ' HG23 ' A' ' 70' ' ' ILE . 68.6 mmt-85 -102.9 116.69 33.03 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.409 ' HD2' ' OE1' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -77.63 -15.92 58.88 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.776 0.322 . . . . 0.0 110.807 -177.668 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.409 ' OE1' ' HD2' ' A' ' 68' ' ' LYS . 6.8 mp0 -60.57 -41.98 95.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.244 175.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.565 HD13 HD22 ' A' ' 74' ' ' LEU . 0.3 OUTLIER -82.98 -19.84 9.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.36 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.521 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -46.57 -41.42 14.41 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 122.569 0.348 . . . . 0.0 111.891 -176.241 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.528 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 10.4 m-20 -59.8 -32.63 70.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.18 -35.15 66.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.09 0.471 . . . . 0.0 109.919 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.565 HD22 HD13 ' A' ' 70' ' ' ILE . 25.4 mt -66.22 -48.65 69.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.594 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.528 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 14.3 ptpt -68.78 -28.03 66.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.855 179.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -73.2 -36.9 66.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.916 0.388 . . . . 0.0 110.672 176.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.473 ' HB1' HD22 ' A' ' 105' ' ' LEU . . . -68.67 -48.0 65.06 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.475 176.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.471 ' HA ' HD12 ' A' ' 105' ' ' LEU . . . -52.76 -34.3 52.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.826 172.055 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 35.4 t60 -64.4 -51.9 60.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.948 0.404 . . . . 0.0 109.929 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.404 ' HB1' ' HB2' ' A' ' 88' ' ' LEU . . . -64.1 -55.56 21.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.187 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -52.68 -34.81 53.64 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.642 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.012 0.434 . . . . 0.0 111.395 176.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.447 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 7.1 t -85.31 15.55 4.27 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.447 ' HB2' ' O ' ' A' ' 83' ' ' SER . 36.3 m-80 73.6 5.18 4.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.589 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -77.21 84.62 3.68 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.859 0.837 . . . . 0.0 110.584 176.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.449 ' NE2' ' HA ' ' A' ' 32' ' ' LEU . 12.6 t-80 -70.36 -39.59 74.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.256 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -60.28 -44.0 95.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.387 -178.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.443 ' O ' HG13 ' A' ' 92' ' ' ILE . 12.7 mt -63.71 -51.48 64.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.736 -177.425 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.58 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -60.55 -39.29 87.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.605 -175.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.962 ' HG2' ' HE2' ' A' ' 33' ' ' LYS . 9.2 mt-30 -65.46 -43.67 89.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.705 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -21.17 64.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.029 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.4 mt -82.12 -60.94 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.505 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.582 HG23 HG22 ' A' ' 98' ' ' ILE . 9.3 mm -55.23 -54.34 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.829 0.347 . . . . 0.0 111.253 178.612 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.48 -33.19 75.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.273 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -69.97 -14.44 70.72 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.225 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.437 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -95.99 3.72 53.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.437 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 84.5 m-20 75.89 7.6 3.69 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.688 0.617 . . . . 0.0 109.621 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.899 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -89.94 139.47 17.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.036 -0.984 . . . . 0.0 109.831 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 p -124.26 162.74 23.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.222 0.535 . . . . 0.0 111.619 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.631 HD21 ' HD2' ' A' ' 101' ' ' PRO . 1.7 tm? -150.1 109.83 3.25 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.463 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.854 ' HB2' HD21 ' A' ' 26' ' ' LEU . 38.0 Cg_endo -64.71 -24.01 62.61 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.185 2.59 . . . . 0.0 113.655 -172.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.526 ' HB2' ' CD1' ' A' ' 100' ' ' LEU . 11.3 m170 -76.29 -18.75 58.81 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.784 0.325 . . . . 0.0 111.283 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.552 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 80.51 11.68 83.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.702 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -93.29 152.02 19.43 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.297 0.57 . . . . 0.0 111.56 -173.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.845 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 2.8 tm? -84.89 -23.36 28.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.209 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.451 HG23 ' HG3' ' A' ' 37' ' ' PRO . 47.0 p -88.46 17.62 5.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.53 -174.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 66.4 mt-10 -150.5 143.21 24.57 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 81.8 m -152.01 139.24 19.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.886 0.374 . . . . 0.0 111.519 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.542 ' HE1' ' HG3' ' A' ' 115' ' ' ARG . 19.7 m-30 -118.94 122.02 41.27 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.469 0.652 . . . . 0.0 109.46 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.952 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.9 t70 -83.32 145.42 29.08 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.009 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.89 -27.49 60.68 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 124.451 1.095 . . . . 0.0 112.271 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.0 mt -76.47 -11.91 59.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.453 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.66 30.22 3.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.253 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.952 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 57.3 m-80 -98.76 157.92 15.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.744 0.307 . . . . 0.0 110.952 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.542 ' HG3' ' HE1' ' A' ' 109' ' ' TYR . 11.4 ttm180 -134.53 122.53 22.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 -174.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . 0.437 ' CZ ' ' HA3' ' A' ' 66' ' ' GLY . 38.5 m-85 -120.85 124.8 45.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.375 175.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.764 ' NE2' ' HZ2' ' A' ' 38' ' ' LYS . 4.0 mm100 -122.34 121.37 36.55 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.523 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.474 HD23 HD11 ' A' ' 123' ' ' LEU . 21.5 tp -98.65 122.2 53.98 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -166.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.574 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 11.2 Cg_exo -74.84 157.38 43.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.974 3.116 . . . . 0.0 113.215 177.715 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 1.01 HG23 ' HE1' ' A' ' 39' ' ' TRP . 20.4 m -72.58 -10.03 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.798 -175.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 0.574 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.1 p90 -56.24 -24.11 40.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -170.407 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 52.2 t -113.4 3.53 15.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.74 0.305 . . . . 0.0 111.111 -176.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.474 HD11 HD23 ' A' ' 118' ' ' LEU . 20.0 mt -125.47 -53.61 1.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.848 0.356 . . . . 0.0 111.842 -174.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.608 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -136.15 111.59 10.13 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.691 0.281 . . . . 0.0 110.764 -176.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.49 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 11.1 Cg_endo -92.78 6.7 3.07 Favored 'Trans proline' 0 CA--C 1.559 1.764 0 C-N-CA 123.281 2.654 . . . . 0.0 117.379 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.608 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 17.4 Cg_endo -59.29 -31.57 95.32 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 122.921 2.079 . . . . 0.0 111.776 174.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.652 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.1 OUTLIER -91.79 39.88 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.091 178.642 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . 0.417 HD21 ' C ' ' A' ' 128' ' ' ASN . 0.2 OUTLIER -109.13 -31.07 7.74 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.534 176.613 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 16.2 tpt -65.36 -42.94 92.25 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.963 0.411 . . . . 0.0 110.218 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.725 HG23 ' HB2' ' A' ' 50' ' ' LEU . 20.7 mm 73.26 -69.37 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.824 175.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 1.014 ' HB3' HG13 ' A' ' 136' ' ' ILE . 9.7 mt-10 -81.61 -172.3 3.78 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.406 -171.211 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.404 ' HB3' ' HD3' ' A' ' 133' ' ' LYS . 34.7 mt-10 -69.02 -175.62 0.76 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -178.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.435 ' H ' ' HD3' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -52.13 -44.79 64.69 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.459 -176.92 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' SER . . . . . 0.409 ' N ' ' HG2' ' A' ' 133' ' ' LYS . 8.7 t 177.14 34.89 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -92.34 -21.83 20.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.615 -171.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 1.014 HG13 ' HB3' ' A' ' 131' ' ' GLU . 3.4 mm -82.38 157.75 3.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.405 -1.27 . . . . 0.0 110.871 -174.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 14.0 mp0 -71.99 -17.75 62.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.9 -176.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.17 109.85 7.01 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.742 -177.339 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 23.2 tp -131.64 -65.75 0.75 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.882 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -93.18 -47.25 7.03 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.417 HD13 HG21 ' A' ' 141' ' ' ILE . 5.0 pt . . . . . 0 C--N 1.319 -0.752 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.868 179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.6 t . . . . . 0 N--CA 1.477 0.88 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 91.9 mt 63.89 95.3 0.05 OUTLIER 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.513 0.508 . . . . 0.0 111.175 -177.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.628 ' OD1' ' HA ' ' A' ' 19' ' ' SER . 66.0 t30 -74.28 61.36 0.88 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.682 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -79.82 -44.71 20.05 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -97.31 102.43 14.2 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 166.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.628 ' HA ' ' OD1' ' A' ' 16' ' ' ASN . 23.2 t -61.71 134.34 56.66 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.217 -173.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -91.0 147.27 23.2 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.771 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -57.18 -8.45 3.38 Favored Glycine 0 C--N 1.335 0.486 0 CA-C-N 115.621 -0.718 . . . . 0.0 114.395 -175.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 8.6 t -59.19 -31.25 68.84 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.147 0.499 . . . . 0.0 110.174 172.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -113.76 -47.06 0.64 Allowed Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 174.4 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.648 HG13 ' HG3' ' A' ' 28' ' ' ARG . 4.6 p 176.86 159.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 177.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.497 ' O ' ' HB3' ' A' ' 19' ' ' SER . . . -86.31 -82.47 0.2 Allowed 'General case' 0 C--N 1.297 -1.685 0 C-N-CA 120.33 -0.548 . . . . 0.0 112.002 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.743 ' H ' HD12 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -76.88 -18.9 58.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.258 -174.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.557 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 127.15 104.31 1.29 Allowed Glycine 0 C--O 1.221 -0.688 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.247 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.648 ' HG3' HG13 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -76.63 -19.63 57.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.039 0.447 . . . . 0.0 111.231 178.817 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.493 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -101.08 157.96 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.349 176.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.789 ' HB3' ' HA2' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -87.19 117.67 68.92 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -168.829 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.774 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 13.4 Cg_exo -72.17 -163.4 0.14 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.227 2.618 . . . . 0.0 111.476 164.833 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.447 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.2 mp -59.99 142.86 53.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.808 0.337 . . . . 0.0 110.985 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.538 ' HE3' ' HB2' ' A' ' 86' ' ' HIS . 0.0 OUTLIER -78.02 71.98 4.52 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.274 0.559 . . . . 0.0 111.586 -178.993 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -87.29 -17.3 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.547 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.27 169.56 17.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.528 0.68 . . . . 0.0 111.729 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -108.62 149.72 39.8 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.215 -176.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.647 ' HG3' HG23 ' A' ' 106' ' ' THR . 22.9 Cg_exo -60.8 138.75 81.35 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.566 2.177 . . . . 0.0 111.665 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.45 ' HB3' ' HE2' ' A' ' 38' ' ' LYS . 3.4 tmmm? -111.17 122.47 47.96 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.891 0.853 . . . . 0.0 112.761 -170.49 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 1.055 ' HE1' HG23 ' A' ' 120' ' ' VAL . 1.9 p-90 175.04 23.26 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 113.058 -1.883 . . . . 0.0 108.159 172.491 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.576 ' HE2' HG12 ' A' ' 127' ' ' ILE . 1.8 tmmt? -142.24 149.55 39.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.444 -156.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.479 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 57.7 m -66.75 119.64 12.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.373 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -64.54 -25.56 68.04 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -130.16 83.6 62.66 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.592 171.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.527 ' HB2' HG12 ' A' ' 130' ' ' ILE . 16.8 Cg_exo -70.03 141.38 43.96 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.636 2.224 . . . . 0.0 112.35 -178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -116.75 -135.63 0.35 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.532 ' CG2' HG23 ' A' ' 136' ' ' ILE . 37.3 p -72.93 -179.88 3.4 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.592 ' OD1' ' HB ' ' A' ' 136' ' ' ILE . 9.7 p-10 -65.68 -37.19 85.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.737 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.8 -38.82 96.71 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.026 -0.607 . . . . 0.0 111.633 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.839 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -71.68 -33.55 68.93 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.612 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.681 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 3.2 tm? -60.49 -52.7 64.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.322 178.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.476 ' HG3' ' N ' ' A' ' 52' ' ' SER . 6.6 ptm180 -65.1 -54.9 22.78 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -176.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.476 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 47.7 m -62.75 -50.9 69.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.421 -174.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.471 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 0.1 OUTLIER -67.94 -28.37 67.41 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.903 -177.718 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.681 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.2 -39.48 94.75 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.801 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.82 -48.32 66.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.243 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.03 -52.41 43.32 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.471 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 17.8 m-85 -59.97 -40.04 87.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.531 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -25.0 61.41 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -73.72 -32.47 63.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.115 0.483 . . . . 0.0 110.859 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 m -92.32 -23.43 19.26 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.324 -174.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.715 ' HB1' ' HD3' ' A' ' 62' ' ' PRO . . . -59.98 -67.02 1.15 Allowed Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.715 ' HD3' ' HB1' ' A' ' 61' ' ' ALA . 88.8 Cg_endo -77.86 -37.25 0.91 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.52 1.48 . . . . 0.0 112.462 -175.16 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 58.36 -90.15 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 171.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -107.76 -7.52 16.33 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -168.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 59.17 -158.46 0.31 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.758 0.314 . . . . 0.0 110.187 -174.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . 0.474 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . 179.75 -138.46 3.44 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.786 177.306 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.674 ' HB3' HG21 ' A' ' 70' ' ' ILE . 7.7 tpt180 -81.12 112.75 18.77 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.56 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 14.3 tptm -61.57 -33.02 73.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.915 0.388 . . . . 0.0 110.584 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.72 -45.18 82.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.62 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.674 HG21 ' HB3' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -77.27 -21.18 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.198 -177.507 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.56 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.32 -42.92 22.23 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.28 0.562 . . . . 0.0 111.208 -176.563 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . 0.558 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 7.9 m-20 -66.04 -25.57 67.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.894 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.6 -29.78 46.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.4 0.619 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.46 HD22 HD13 ' A' ' 70' ' ' ILE . 17.2 mt -70.19 -51.2 32.92 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.506 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 13.2 ptpt -64.89 -32.74 74.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.867 178.459 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.416 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.26 -35.57 73.88 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.752 0.311 . . . . 0.0 110.945 176.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.55 ' HB1' ' HB3' ' A' ' 89' ' ' ALA . . . -68.87 -46.91 67.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.484 176.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.549 ' HB3' HD22 ' A' ' 123' ' ' LEU . . . -52.59 -36.02 55.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.419 173.087 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.519 ' O ' ' HB2' ' A' ' 82' ' ' GLU . 63.6 t60 -62.98 -47.09 84.65 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.342 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.06 -51.32 59.26 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.56 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.528 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 1.8 t80 -54.04 -34.7 60.72 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.891 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.539 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 28.6 mt-10 -51.37 -48.72 62.43 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 175.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.541 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 15.2 m -76.41 -19.69 57.85 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.731 -173.453 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . 0.541 ' HB2' ' O ' ' A' ' 83' ' ' SER . 9.7 t30 138.93 -17.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.226 0 O-C-N 124.947 1.405 . . . . 0.0 109.846 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.542 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 0.2 OUTLIER -71.73 90.63 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -165.106 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.692 ' O ' ' HG2' ' A' ' 90' ' ' GLN . 27.4 t-80 -70.45 -44.99 66.66 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.011 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . 0.428 ' H ' ' CD ' ' A' ' 87' ' ' GLU . 1.7 pm0 -62.96 -47.03 84.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.73 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.524 ' O ' HG13 ' A' ' 92' ' ' ILE . 4.2 mt -54.45 -56.36 19.52 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.251 0.548 . . . . 0.0 110.838 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.743 ' HB3' HD21 ' A' ' 105' ' ' LEU . . . -61.31 -42.64 99.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.766 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.692 ' HG2' ' O ' ' A' ' 86' ' ' HIS . 22.6 mm-40 -63.74 -38.45 91.14 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.171 -0.211 . . . . 0.0 111.18 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.77 -30.77 69.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.906 0.384 . . . . 0.0 110.284 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.524 HG13 ' O ' ' A' ' 88' ' ' LEU . 57.2 mt -69.71 -59.97 2.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.851 178.084 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.575 ' CG2' HG22 ' A' ' 98' ' ' ILE . 8.5 mm -52.4 -57.17 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.134 0.492 . . . . 0.0 111.005 178.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -64.56 -24.49 67.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.042 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.57 -19.2 68.78 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.697 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -101.53 4.24 40.89 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.692 -0.299 . . . . 0.0 110.603 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 3.7 m-20 72.9 8.11 5.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.565 0.698 . . . . 0.0 110.107 -174.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.984 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.6 mp -82.05 136.92 22.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.82 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.538 ' HA ' ' OE1' ' A' ' 30' ' ' GLN . 25.6 p -138.61 171.18 14.73 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.409 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.583 ' HG ' ' O ' ' A' ' 107' ' ' GLU . 1.5 tm? -148.52 114.33 3.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.565 ' HD2' HD21 ' A' ' 100' ' ' LEU . 34.7 Cg_endo -65.13 -17.62 59.32 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.492 2.795 . . . . 0.0 114.558 -174.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.577 ' HB2' ' CD1' ' A' ' 100' ' ' LEU . 18.8 m-70 -79.93 -23.22 41.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.179 0.514 . . . . 0.0 111.033 177.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.789 ' HA2' ' HB3' ' A' ' 30' ' ' GLN . . . 75.99 17.29 80.12 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.392 -0.909 . . . . 0.0 111.567 -172.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -94.96 141.38 28.72 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 121.168 0.509 . . . . 0.0 110.406 -176.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.743 HD21 ' HB3' ' A' ' 89' ' ' ALA . 0.3 OUTLIER -75.29 -21.63 58.34 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.9 -1.046 . . . . 0.0 109.005 179.122 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.647 HG23 ' HG3' ' A' ' 37' ' ' PRO . 64.4 p -90.71 15.05 11.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.936 -173.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.583 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.4 mt-10 -148.55 143.87 26.91 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 175.034 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.8 m -150.75 139.17 20.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.524 0.202 . . . . 0.0 110.523 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -118.92 123.16 43.96 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.343 0.592 . . . . 0.0 109.967 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 0.984 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.3 t70 -87.11 147.22 25.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.503 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.55 -24.71 57.63 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.112 -172.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 27.4 mt -76.71 -3.04 35.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 110.938 -178.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.11 34.39 6.48 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 0.772 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 11.6 m120 -106.6 157.88 17.35 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -139.95 139.16 36.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.229 0.537 . . . . 0.0 110.942 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . 0.426 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 40.1 m-85 -124.91 127.75 47.57 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.921 175.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -121.38 122.52 40.01 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -176.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.488 HD21 HD13 ' A' ' 123' ' ' LEU . 30.8 tp -102.53 123.29 43.28 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.065 -167.915 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.653 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 20.4 Cg_exo -69.48 155.76 65.94 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.737 2.958 . . . . 0.0 112.751 176.138 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 1.055 HG23 ' HE1' ' A' ' 39' ' ' TRP . 20.2 m -66.17 -17.71 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.656 -175.167 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 0.653 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.3 p90 -60.65 -22.14 63.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -166.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.7 t -110.59 1.48 18.1 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.601 -174.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.549 HD22 ' HB3' ' A' ' 78' ' ' ALA . 90.3 mt -130.31 -37.02 1.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 0.0 111.808 -177.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -117.46 112.53 39.19 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.439 -175.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.538 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 51.3 Cg_exo -56.38 -34.91 95.51 Favored 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.648 2.899 . . . . 0.0 115.674 177.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 48.8 Cg_endo -67.31 -149.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.365 1.444 0 C-N-CA 121.778 1.652 . . . . 0.0 112.459 175.504 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.576 HG12 ' HE2' ' A' ' 40' ' ' LYS . 4.0 mp 52.93 52.63 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.146 0 CA-C-O 122.383 1.087 . . . . 0.0 109.759 -174.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -147.68 106.59 3.84 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.002 -175.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 51.8 ttp 69.21 111.3 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 O-C-N 124.069 0.856 . . . . 0.0 111.159 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.527 HG12 ' HB2' ' A' ' 44' ' ' PRO . 4.0 mp -101.33 -65.27 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.108 -177.091 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -113.14 82.78 1.72 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.31 0.576 . . . . 0.0 109.935 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 60.82 -176.4 0.11 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 114.722 -1.126 . . . . 0.0 112.765 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.888 ' H ' ' HD3' ' A' ' 133' ' ' LYS . 2.1 mppt? -61.91 -65.3 0.71 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 122.037 0.922 . . . . 0.0 110.3 -175.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 5.3 p -170.1 48.58 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 113.893 -1.503 . . . . 0.0 107.267 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -94.79 -29.44 14.75 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.15 -172.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.592 ' HB ' ' OD1' ' A' ' 47' ' ' ASP . 28.3 mm -68.33 -86.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.514 -174.066 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -76.16 41.31 0.23 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -174.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 16.5 m -111.18 57.83 0.62 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 122.036 0.922 . . . . 0.0 108.619 171.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.4 tp -91.36 -0.74 57.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.634 -1.167 . . . . 0.0 109.247 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 29.5 t70 77.59 28.34 0.58 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 122.597 1.189 . . . . 0.0 108.661 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 27.3 pt . . . . . 0 C--N 1.316 -0.864 0 CA-C-N 114.001 -1.454 . . . . 0.0 110.077 175.642 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.6 m . . . . . 0 N--CA 1.477 0.887 0 CA-C-O 120.739 0.304 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.09 105.98 17.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.764 0.316 . . . . 0.0 110.579 -178.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -114.95 118.84 34.58 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -136.97 150.71 48.33 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.039 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 66.0 t30 73.91 -13.72 0.73 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 124.019 0.825 . . . . 0.0 111.922 174.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' ' 22' ' ' THR . 6.3 p -82.78 51.57 1.93 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.18 0.514 . . . . 0.0 111.03 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -81.15 112.53 18.59 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.701 -177.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.14 14.35 62.54 Favored Glycine 0 CA--C 1.507 -0.424 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.245 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.41 ' O ' ' HB2' ' A' ' 19' ' ' SER . 3.2 t -153.39 92.08 1.56 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.328 0.585 . . . . 0.0 109.669 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -69.98 80.9 0.35 Allowed Glycine 0 C--N 1.332 0.309 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.489 -177.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.735 HG13 ' HG2' ' A' ' 28' ' ' ARG . 78.7 t -124.14 -71.88 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.552 0.215 . . . . 0.0 110.626 -177.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -176.13 -66.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.739 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.429 ' N ' HD12 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -121.6 -10.91 8.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.713 172.967 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.588 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 113.04 110.11 2.98 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.712 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . 0.735 ' HG2' HG13 ' A' ' 24' ' ' VAL . 10.8 mtm180 -56.41 -52.01 66.24 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.036 0.446 . . . . 0.0 110.751 177.528 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.453 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 26.1 p-10 -91.1 156.75 17.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.621 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . 0.857 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 3.7 pm0 -88.78 118.16 69.03 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 121.787 0.804 . . . . 0.0 112.219 -170.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.629 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 5.2 Cg_exo -77.4 -164.38 0.26 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.493 2.795 . . . . 0.0 111.435 169.517 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.543 ' HG ' ' NE2' ' A' ' 86' ' ' HIS . 7.7 tt -40.82 120.71 1.35 Allowed 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 173.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LYS . . . . . 0.725 ' HB3' ' H ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -56.83 121.75 10.6 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 121.473 0.654 . . . . 0.0 111.655 -177.426 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -95.2 -33.92 12.43 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.395 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.14 170.1 12.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.516 174.269 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -110.53 162.37 20.83 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.56 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.46 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 22.0 Cg_exo -59.98 123.26 12.83 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.625 1.55 . . . . 0.0 110.839 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.639 ' HZ1' ' NE2' ' A' ' 117' ' ' GLN . 3.4 tmmm? -108.09 122.14 46.28 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.891 0.853 . . . . 0.0 112.207 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' TRP . . . . . 0.955 ' HE1' HG23 ' A' ' 120' ' ' VAL . 2.5 p-90 171.08 24.27 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.795 -2.002 . . . . 0.0 107.882 177.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.573 ' HD2' ' N ' ' A' ' 41' ' ' SER . 1.2 tmmt? -141.13 152.88 45.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.298 -153.742 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . 0.573 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 48.2 m -64.62 127.29 30.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.447 -177.219 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -61.72 -29.54 70.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.86 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -147.56 95.95 4.21 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.693 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.52 129.02 13.24 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.667 2.244 . . . . 0.0 111.866 176.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' MET . . . . . 0.608 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.6 mtp -94.27 -85.27 0.3 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.057 -179.193 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.0 p -114.85 -178.16 3.3 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.423 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . 0.626 ' HB2' ' HE2' ' A' ' 129' ' ' MET . 9.0 p-10 -69.22 -33.36 73.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.81 0.338 . . . . 0.0 110.336 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.71 -38.05 95.62 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.619 176.556 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.608 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 15.7 mm100 -70.94 -41.54 71.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.856 0.36 . . . . 0.0 110.181 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.433 ' HG ' ' H ' ' A' ' 130' ' ' ILE . 1.0 OUTLIER -57.74 -50.42 73.27 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.455 -179.043 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.493 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 7.2 ptm180 -66.51 -42.41 87.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.7 t -65.61 -52.08 54.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.924 0.392 . . . . 0.0 110.286 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.433 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 3.4 tppt? -63.1 -35.28 79.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.431 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -56.81 -46.94 81.29 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.902 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.48 -46.11 73.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.003 0.43 . . . . 0.0 110.86 -177.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -53.44 -49.57 67.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.799 175.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.428 ' CE2' ' HG3' ' A' ' 53' ' ' LYS . 19.0 m-85 -63.22 -43.91 96.76 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.1 176.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' TRP . . . . . 0.654 ' HZ3' ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -49.6 -36.06 22.89 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 178.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -70.16 -26.12 63.77 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.6 m -96.12 -24.31 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.757 0.789 . . . . 0.0 109.821 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.528 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -68.32 159.18 82.02 Favored Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.405 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.528 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 21.4 Cg_endo -82.9 -9.52 10.79 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.99 2.46 . . . . 0.0 112.713 -173.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.654 ' HA ' ' HZ3' ' A' ' 58' ' ' TRP . . . 59.5 -141.75 0.63 Allowed 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.894 -177.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -103.38 0.54 31.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.092 0.472 . . . . 0.0 109.869 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -68.56 161.24 28.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.937 -175.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 123.28 179.03 15.66 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.576 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.492 ' O ' HG23 ' A' ' 70' ' ' ILE . 37.7 mtt180 -65.89 109.75 2.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.962 0.41 . . . . 0.0 110.266 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.743 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 72.9 mmtt -64.84 -23.41 67.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.681 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLU . . . . . 0.423 ' H ' ' HG3' ' A' ' 69' ' ' GLU . 22.6 mt-10 -52.51 -53.63 43.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.031 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.606 HG13 ' CD1' ' A' ' 98' ' ' ILE . 0.0 OUTLIER -82.84 -25.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.668 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' TRP . . . . . 0.743 ' HB2' ' HA ' ' A' ' 68' ' ' LYS . 5.9 m95 -52.41 -35.95 53.14 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.053 177.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -55.68 -39.35 70.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.426 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.35 -28.76 37.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 110.382 -175.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.492 HD22 ' CD1' ' A' ' 70' ' ' ILE . 21.8 mt -64.65 -49.87 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.25 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.628 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 10.7 ptpt -73.43 -26.68 61.05 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.093 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . 0.471 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -67.33 -41.11 85.77 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.895 0.379 . . . . 0.0 110.636 175.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ALA . . . . . 0.584 ' HB1' ' HB3' ' A' ' 89' ' ' ALA . . . -66.94 -50.93 60.82 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.206 176.121 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . 0.587 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -51.29 -32.89 26.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.733 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.471 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 65.5 t60 -62.56 -50.67 70.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.894 0.378 . . . . 0.0 110.468 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.08 -52.06 52.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.559 177.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.484 ' CE1' ' HD2' ' A' ' 33' ' ' LYS . 10.4 t80 -55.68 -26.79 46.65 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.32 178.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.587 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.0 mt-10 -57.22 -34.56 68.68 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.671 -0.643 . . . . 0.0 110.785 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.5 t -90.77 16.62 8.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.461 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.8 t30 70.68 8.52 6.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.397 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.589 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 11.0 t0 -76.07 93.37 3.3 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.784 -177.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' HIS . . . . . 0.638 ' O ' ' HG3' ' A' ' 90' ' ' GLN . 66.2 m80 -71.37 -50.79 28.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.777 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -58.61 -40.65 83.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.191 -171.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.532 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.8 mt -59.01 -52.48 65.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.89 0.376 . . . . 0.0 110.812 176.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.873 ' HB3' HD21 ' A' ' 105' ' ' LEU . . . -65.59 -40.02 92.22 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.467 -175.173 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.638 ' HG3' ' O ' ' A' ' 86' ' ' HIS . 19.9 mt-30 -58.08 -46.59 85.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.468 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.15 -25.08 60.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.724 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 88' ' ' LEU . 46.4 mt -69.91 -59.43 3.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.641 0.258 . . . . 0.0 110.628 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ILE . . . . . 0.574 ' CG2' HG22 ' A' ' 98' ' ' ILE . 10.6 mm -53.04 -59.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.301 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -63.93 -25.26 68.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.364 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.97 56.11 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.622 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . 0.692 ' HB1' HD11 ' A' ' 98' ' ' ILE . . . -112.41 15.89 20.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 122.548 -0.384 . . . . 0.0 111.574 -179.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 83.5 m-20 72.2 9.72 5.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 122.041 0.924 . . . . 0.0 108.948 -177.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ILE . . . . . 0.692 HD11 ' HB1' ' A' ' 96' ' ' ALA . 50.3 mt -96.25 138.03 22.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.594 -176.208 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' THR . . . . . 0.618 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 34.3 p -139.13 168.66 19.34 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.227 -0.589 . . . . 0.0 112.178 -170.496 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LEU . . . . . 0.857 ' HB3' ' HB3' ' A' ' 30' ' ' GLN . 2.7 tm? -149.38 99.62 3.39 Favored Pre-proline 0 N--CA 1.452 -0.354 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.086 174.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' PRO . . . . . 0.588 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 56.0 Cg_endo -66.68 -10.72 29.07 Favored 'Trans proline' 0 N--CA 1.475 0.383 0 C-N-CA 123.433 2.756 . . . . 0.0 113.29 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' HIS . . . . . 0.67 ' HB2' HD11 ' A' ' 100' ' ' LEU . 48.8 m170 -84.02 -9.85 58.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.702 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLY . . . . . 0.629 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 67.84 38.15 89.03 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.623 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ALA . . . . . 0.73 ' H ' HD13 ' A' ' 100' ' ' LEU . . . -122.67 139.39 54.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.287 0.565 . . . . 0.0 111.391 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.873 HD21 ' HB3' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -76.9 -22.08 53.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.043 -0.98 . . . . 0.0 108.412 176.625 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.531 HG22 HD12 ' A' ' 123' ' ' LEU . 59.1 p -91.84 18.11 8.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.606 -172.183 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.606 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.7 mt-10 -150.62 149.14 29.49 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 171.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . 0.422 ' SG ' HD21 ' A' ' 74' ' ' LEU . 80.6 m -150.55 144.09 25.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.798 0.332 . . . . 0.0 110.416 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . 0.641 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 18.0 m-30 -118.48 121.73 40.99 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.093 0.473 . . . . 0.0 109.835 177.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASP . . . . . 1.035 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.3 t70 -79.78 145.18 32.98 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.597 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -59.6 -24.47 63.82 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.967 -168.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 mt -76.82 -13.73 59.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.118 0.485 . . . . 0.0 110.495 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.23 28.05 3.2 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.452 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASN . . . . . 1.035 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 51.5 m-80 -94.1 143.01 26.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.794 0.297 . . . . 0.0 110.766 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.641 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 53.2 ttp180 -123.3 121.19 35.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -127.16 140.7 52.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.942 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLN . . . . . 0.639 ' NE2' ' HZ1' ' A' ' 38' ' ' LYS . 25.8 mt-30 -123.11 146.36 47.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LEU . . . . . 0.614 HD12 ' HD2' ' A' ' 119' ' ' PRO . 15.8 tp -111.96 121.98 38.15 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -167.227 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.614 ' HD2' HD12 ' A' ' 118' ' ' LEU . 14.5 Cg_exo -72.13 157.49 54.01 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.847 3.031 . . . . 0.0 113.372 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' VAL . . . . . 0.955 HG23 ' HE1' ' A' ' 39' ' ' TRP . 9.3 m -69.62 -14.41 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.385 -175.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' TYR . . . . . 0.597 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -56.46 -22.3 31.28 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -168.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 40.7 t -124.75 16.41 8.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.818 0.342 . . . . 0.0 110.919 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' LEU . . . . . 0.531 HD12 HG22 ' A' ' 106' ' ' THR . 72.7 mt -131.63 -54.34 1.01 Allowed 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.138 -0.351 . . . . 0.0 111.705 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . 0.512 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -129.98 111.74 17.17 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.828 0.346 . . . . 0.0 110.583 -175.131 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' PRO . . . . . 0.424 ' N ' ' CD ' ' A' ' 126' ' ' PRO . 89.8 Cg_endo -87.54 -4.67 7.4 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.029 2.486 . . . . 0.0 117.787 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' PRO . . . . . 0.512 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 30.6 Cg_endo -63.89 -26.31 67.14 Favored 'Trans proline' 0 C--N 1.371 1.734 0 CA-C-N 123.076 2.134 . . . . 0.0 112.499 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' ILE . . . . . 0.74 HD11 ' H ' ' A' ' 127' ' ' ILE . 0.2 OUTLIER -105.6 45.52 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.438 0.637 . . . . 0.0 110.107 179.269 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -79.4 -56.54 4.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.898 -172.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' MET . . . . . 0.626 ' HE2' ' HB2' ' A' ' 47' ' ' ASP . 16.5 tpt -152.84 86.3 1.25 Allowed 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 177.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' ILE . . . . . 0.433 ' H ' ' HG ' ' A' ' 50' ' ' LEU . 33.2 mm -71.28 146.39 11.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.629 -177.672 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' GLU . . . . . 0.51 ' HG2' ' HB3' ' A' ' 47' ' ' ASP . 19.2 mt-10 -139.34 -156.49 0.68 Allowed 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.086 -176.279 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' GLU . . . . . 0.51 ' HB2' HD12 ' A' ' 136' ' ' ILE . 3.8 mm-40 -65.58 -173.7 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.44 -178.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LYS . . . . . 0.675 ' HZ2' ' HB3' ' A' ' 133' ' ' LYS . 6.6 ttpm? -46.09 -72.96 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.364 -1.289 . . . . 0.0 112.769 -176.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 7.7 t -175.25 25.98 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.089 0.947 . . . . 0.0 108.605 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -100.51 -13.54 18.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.591 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' ILE . . . . . 0.51 HD12 ' HB2' ' A' ' 132' ' ' GLU . 32.8 mm -51.54 134.61 12.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.516 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' GLU . . . . . 0.509 ' O ' HD12 ' A' ' 139' ' ' LEU . 9.9 pt-20 37.34 77.32 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 O-C-N 124.271 0.982 . . . . 0.0 111.584 -170.137 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 5.0 m -54.36 107.64 0.3 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.595 -176.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' LEU . . . . . 0.509 HD12 ' O ' ' A' ' 137' ' ' GLU . 7.8 mp -73.02 134.88 44.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.054 0.454 . . . . 0.0 111.15 179.093 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -95.43 -25.6 16.19 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 172.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' ILE . . . . . 0.407 HD11 HG21 ' A' ' 141' ' ' ILE . 3.7 pt . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.685 177.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.55 ' O ' ' HB ' ' A' ' 99' ' ' THR . 2.4 ppt_? . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.403 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 3.5 p-10 -94.89 149.2 21.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 173.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.782 ' HG3' ' HA2' ' A' ' 103' ' ' GLY . 7.9 tt0 -83.62 119.09 73.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -165.063 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.535 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 5.8 Cg_exo -78.6 -164.53 0.28 Allowed 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.876 3.051 . . . . 0.0 112.125 171.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp -52.3 132.78 34.46 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 122.777 0.431 . . . . 0.0 111.183 178.363 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.727 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -80.76 87.81 5.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.273 0.559 . . . . 0.0 111.435 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.669 ' HD2' ' N ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -98.5 -25.06 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.106 175.913 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.669 ' N ' ' HD2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -50.73 151.32 2.45 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.389 -178.326 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.721 ' H ' ' HD2' ' A' ' 36' ' ' LYS . 1.2 mptt -96.05 159.95 31.06 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.681 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.605 ' HB2' HG12 ' A' ' 120' ' ' VAL . 13.8 Cg_exo -67.44 135.88 37.93 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.88 1.72 . . . . 0.0 111.063 174.079 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.65 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 32.5 ttpt -111.71 141.47 45.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.276 -0.42 . . . . 0.0 112.078 -168.198 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 1.071 ' HE1' HG22 ' A' ' 120' ' ' VAL . 3.1 p-90 147.51 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 O-C-N 125.281 1.613 . . . . 0.0 110.357 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.603 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.73 171.28 7.68 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.042 -176.847 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.467 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 15.0 m -64.61 133.28 51.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.776 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -71.43 -31.86 67.7 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -129.51 85.24 59.38 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.84 170.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.467 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 4.3 Cg_exo -75.86 134.23 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.417 2.078 . . . . 0.0 110.534 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.703 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 90.8 mtp -102.98 -81.99 0.5 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.963 0.411 . . . . 0.0 110.699 -178.513 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.4 p -115.37 -177.12 3.07 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.218 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -53.14 -49.64 66.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.263 0.352 . . . . 0.0 111.197 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.57 -48.03 84.16 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.127 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.703 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 75.3 mm-40 -61.82 -45.08 95.38 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.98 -57.35 13.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.621 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.8 ptm180 -63.51 -45.05 92.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.6 m -64.79 -53.02 53.59 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 121.23 -0.188 . . . . 0.0 111.013 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.419 -0.513 . . . . 0.0 111.269 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.556 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 45.6 ttp180 -53.34 -53.52 49.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.658 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -66.26 -43.71 85.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.69 -177.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -51.7 -52.24 49.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.241 176.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -71.38 -36.86 71.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.69 0.281 . . . . 0.0 110.728 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.556 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -49.83 -41.61 45.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.587 176.539 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -58.22 -28.57 64.97 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.723 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.7 m -103.05 -0.22 31.07 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.458 -172.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.776 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -75.58 -75.58 0.1 OUTLIER Pre-proline 0 CA--C 1.544 0.737 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -173.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.776 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 77.7 Cg_endo . . . . . 0 C--N 1.352 0.73 0 C-N-CA 121.389 1.392 . . . . 0.0 113.478 -167.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.429 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.447 -0.569 0 N-CA-C 114.375 0.51 . . . . 0.0 114.375 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.715 ' HB3' HG22 ' A' ' 70' ' ' ILE . 13.1 tpt180 -155.76 106.95 2.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.729 0.299 . . . . 0.0 110.385 -169.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.518 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 75.7 mmtt -63.76 -28.36 69.83 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.351 0.596 . . . . 0.0 109.708 174.373 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HB2' ' HG3' ' A' ' 67' ' ' ARG . 18.1 mm-40 -59.63 -40.15 86.66 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.634 177.568 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.715 HG22 ' HB3' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -82.68 -23.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.991 -178.586 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.67 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -48.71 -38.42 21.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.799 -177.258 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -52.6 -40.98 63.25 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.196 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 -32.91 59.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.266 0.555 . . . . 0.0 110.294 -176.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.505 HD22 ' SG ' ' A' ' 108' ' ' CYS . 32.4 mt -68.4 -43.72 76.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.929 -175.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.3 ptpt -74.56 -30.45 61.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.451 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.36 -35.68 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.967 0.413 . . . . 0.0 110.483 175.744 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.0 -45.09 75.06 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.352 176.189 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.607 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -50.04 -39.33 41.54 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.57 0.544 . . . . 0.0 110.805 171.088 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.447 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 71.3 t60 -60.9 -51.0 71.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.473 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.31 -50.03 69.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.774 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -60.25 -37.23 79.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.433 -177.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -60.46 -32.04 71.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 110.724 174.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 11.3 m -89.36 16.94 6.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.44 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' SER . 52.3 m-80 77.5 3.55 3.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.831 0.852 . . . . 0.0 111.741 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.536 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 7.3 m-20 -80.24 84.68 5.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 110.324 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -70.93 -43.24 68.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.972 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -63.75 -39.64 94.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.139 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.536 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 12.1 mt -60.11 -49.0 79.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.795 0.331 . . . . 0.0 110.823 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.649 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -64.54 -34.16 77.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.127 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -64.8 -44.64 89.27 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.723 0.297 . . . . 0.0 110.784 173.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ALA . . . . . 0.51 ' O ' ' HA3' ' A' ' 95' ' ' GLY . . . -67.63 -21.26 65.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.909 -177.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.5 mt -83.3 -61.62 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.433 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.649 HG12 ' O ' ' A' ' 89' ' ' ALA . 7.9 mm -56.46 -62.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.517 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.616 ' OD1' ' HB3' ' A' ' 30' ' ' GLN . 3.5 m-20 -72.53 -14.59 61.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.358 -178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLY . . . . . 0.51 ' HA3' ' O ' ' A' ' 91' ' ' ALA . . . -74.13 -21.62 78.82 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.174 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -83.01 -55.62 4.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 110.647 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 65.0 t30 156.31 -30.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -176.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.968 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -54.24 137.05 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 112.936 -1.938 . . . . 0.0 110.947 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 11.2 p -144.57 174.14 11.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.324 0.583 . . . . 0.0 112.175 -175.156 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.766 HD11 ' O ' ' A' ' 107' ' ' GLU . 82.8 mt -145.73 137.31 12.94 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.463 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.33 -6.94 13.91 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.312 1.341 . . . . 0.0 110.45 164.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -80.79 -59.65 2.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.893 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLY . . . . . 0.782 ' HA2' ' HG3' ' A' ' 30' ' ' GLN . . . 95.19 40.74 4.19 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.083 -1.055 . . . . 0.0 111.912 -172.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.401 ' H ' HD13 ' A' ' 100' ' ' LEU . . . -115.77 153.4 31.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.323 0.582 . . . . 0.0 111.476 -177.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.607 HD11 ' HA ' ' A' ' 78' ' ' ALA . 2.0 tm? -91.25 -16.44 27.6 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.4 p -91.91 9.68 31.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.947 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.766 ' O ' HD11 ' A' ' 100' ' ' LEU . 27.6 mt-10 -145.59 151.96 38.93 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.409 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.505 ' SG ' HD22 ' A' ' 74' ' ' LEU . 94.4 m -155.86 138.73 15.3 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.385 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -115.73 123.06 47.33 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.717 0.77 . . . . 0.0 110.09 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ASP . . . . . 0.968 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.8 t70 -91.75 152.67 20.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.247 -1.342 . . . . 0.0 110.307 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.5 -23.43 65.91 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.244 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.426 ' HB2' ' ND2' ' A' ' 114' ' ' ASN . 21.4 mt -78.83 1.83 22.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.959 0.409 . . . . 0.0 111.014 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.67 26.81 12.4 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.957 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 90.2 m-20 -101.98 155.27 18.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.888 -173.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -138.52 137.46 37.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.084 0.469 . . . . 0.0 110.609 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 13.0 m-85 -117.76 132.45 56.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.437 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 6.2 mm-40 -123.86 121.36 35.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 -176.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 33.9 tp -103.75 120.59 50.94 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -169.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.583 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 21.2 Cg_exo -71.38 156.42 58.64 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 123.869 3.046 . . . . 0.0 112.79 175.263 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.071 HG22 ' HE1' ' A' ' 39' ' ' TRP . 21.1 m -67.72 -18.75 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.896 -172.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.583 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 3.9 p90 -61.01 -18.13 56.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.843 0.354 . . . . 0.0 111.546 -170.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.9 t -103.44 -0.56 29.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.436 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -137.08 -54.35 0.7 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -175.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.483 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -135.11 119.34 13.4 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.517 -170.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 68.7 Cg_endo -101.48 21.64 0.19 Allowed 'Trans proline' 0 CA--C 1.558 1.69 0 C-N-CA 122.945 2.43 . . . . 0.0 117.002 178.354 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.483 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 41.9 Cg_endo -70.04 -34.49 13.56 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-N 122.339 1.871 . . . . 0.0 111.897 175.471 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.82 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.236 0 CA-C-O 121.56 0.695 . . . . 0.0 110.852 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.684 ' O ' ' HB ' ' A' ' 99' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.924 0.392 . . . . 0.0 111.385 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.601 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 30.8 p-10 -108.91 158.7 17.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 170.062 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -80.27 111.32 21.38 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -162.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.671 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 4.8 Cg_exo -79.71 -164.57 0.29 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.743 2.962 . . . . 0.0 109.972 166.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 28.4 tp -52.74 132.06 35.82 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 176.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.537 ' HE3' ' CZ ' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -57.25 109.53 0.68 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.361 0.6 . . . . 0.0 111.319 -175.656 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.877 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 10.8 mmpt? -97.55 -19.86 18.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.053 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.19 170.07 8.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.493 0.664 . . . . 0.0 111.605 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -109.38 159.85 29.87 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.04 -177.091 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.732 ' HB2' HG12 ' A' ' 120' ' ' VAL . 33.1 Cg_exo -51.29 128.73 26.39 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.567 2.178 . . . . 0.0 112.294 -175.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.486 ' HE2' ' HB3' ' A' ' 38' ' ' LYS . 24.3 ttpt -113.46 123.21 49.5 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.253 -170.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 1.02 ' HE1' HG22 ' A' ' 120' ' ' VAL . 3.1 p-90 -176.3 25.17 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.666 -1.152 . . . . 0.0 109.441 172.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HE2' HG21 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -157.59 166.02 34.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.979 -167.309 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 52.1 m -69.37 128.75 37.66 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 165.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -76.92 -18.31 58.37 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TYR . . . . . 0.519 ' CE2' ' HG2' ' A' ' 45' ' ' MET . 51.2 t80 -133.34 75.0 71.05 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.215 170.153 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.513 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 50.4 Cg_exo -62.45 -26.36 76.47 Favored 'Trans proline' 0 CA--C 1.508 -0.809 0 C-N-CA 123.853 3.035 . . . . 0.0 113.549 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.519 ' HG2' ' CE2' ' A' ' 43' ' ' TYR . 54.1 mtt 78.18 -82.64 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.696 -1.593 . . . . 0.0 110.797 -177.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.3 p -115.69 175.85 5.34 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.102 -177.344 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.604 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 0.8 OUTLIER -68.12 -36.7 80.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.432 0.158 . . . . 0.0 110.618 -177.966 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.08 -41.94 94.83 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.167 -0.54 . . . . 0.0 111.863 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.513 ' HB2' ' O ' ' A' ' 44' ' ' PRO . 17.8 mm-40 -74.46 -38.49 62.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.8 tp -54.48 -54.34 42.28 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.299 0.375 . . . . 0.0 111.15 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 14.9 ptm180 -64.51 -47.1 80.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.323 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.1 t -60.64 -45.35 94.38 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.684 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.482 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 65.5 mmtt -72.72 -30.09 63.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.495 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -57.94 -41.32 82.54 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.55 -50.64 35.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.438 0.637 . . . . 0.0 110.745 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -54.91 -46.85 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.633 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.482 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 34.0 m-85 -70.48 -36.43 73.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.467 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -30.58 48.0 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.388 0.43 . . . . 0.0 111.223 176.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -60.62 -34.25 73.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 112.074 173.69 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 m -100.0 -27.1 13.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.977 -171.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.506 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -52.1 -52.93 57.48 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -175.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.506 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 49.4 Cg_endo . . . . . 0 C--N 1.348 0.525 0 C-N-CA 122.166 1.911 . . . . 0.0 112.877 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.492 ' HA2' ' OD1' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.432 -1.609 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.664 ' O ' HG22 ' A' ' 70' ' ' ILE . 33.7 mmt180 -66.51 94.72 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 171.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' A' ' 68' ' ' LYS . 15.1 tptm -50.85 -37.11 41.29 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.793 -171.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -58.41 -33.43 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.664 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -82.77 -22.52 8.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.229 -178.618 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.626 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -50.62 -37.2 38.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.808 -173.285 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -59.24 -34.24 71.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.326 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.22 -29.01 42.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.02 0.438 . . . . 0.0 110.091 -178.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.605 HD21 HD13 ' A' ' 70' ' ' ILE . 34.2 mt -67.96 -49.27 62.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.467 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.4 ptpt -69.01 -28.99 67.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.708 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.74 -38.72 76.92 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.179 176.609 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.402 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -67.95 -51.35 48.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.618 178.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -51.54 -34.13 35.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 172.177 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 28.5 t60 -64.18 -47.55 79.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.133 0.492 . . . . 0.0 109.81 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.46 ' HB1' ' HB2' ' A' ' 88' ' ' LEU . . . -68.85 -53.46 21.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.537 ' CZ ' ' HE3' ' A' ' 33' ' ' LYS . 12.7 t80 -54.44 -28.5 44.55 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.802 177.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -63.17 -28.82 70.32 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.591 -0.693 . . . . 0.0 111.229 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.7 t -92.15 15.26 13.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.469 0.652 . . . . 0.0 109.455 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 57.4 t30 70.71 7.44 6.22 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.012 -178.279 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.435 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 4.7 m-20 -73.84 82.05 1.64 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.199 0.524 . . . . 0.0 110.441 176.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 -72.09 -37.25 69.61 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.458 174.362 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 88' ' ' LEU . 10.2 pt-20 -53.67 -43.7 69.07 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.699 178.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.482 ' O ' HG13 ' A' ' 92' ' ' ILE . 14.5 mt -65.65 -51.93 55.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.981 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.573 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -63.27 -40.11 96.47 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.92 -176.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -66.17 -38.78 88.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.772 0.32 . . . . 0.0 110.195 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.55 -21.0 61.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.666 -179.116 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.3 mt -81.84 -60.68 2.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.861 177.051 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.573 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -52.66 -61.81 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.416 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.26 -25.25 65.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.564 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -75.24 -12.61 83.41 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.951 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -102.07 6.63 41.09 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.987 -0.126 . . . . 0.0 110.881 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.8 t30 74.14 8.11 4.69 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.982 0.896 . . . . 0.0 109.525 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.934 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -90.51 138.2 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.348 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.684 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 19.8 p -123.19 164.79 18.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.362 -177.038 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.851 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.6 tm? -150.42 104.11 3.11 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.483 178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.713 ' HD2' HD22 ' A' ' 100' ' ' LEU . 67.4 Cg_endo -71.62 -7.9 22.12 Favored 'Trans proline' 0 N--CA 1.476 0.475 0 C-N-CA 123.325 2.684 . . . . 0.0 114.216 -173.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.635 ' H ' HD13 ' A' ' 100' ' ' LEU . 29.7 m-70 -82.72 -15.45 51.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 177.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLY . . . . . 0.671 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 68.77 37.67 84.51 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.275 -176.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.851 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -135.36 152.76 51.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 121.267 0.556 . . . . 0.0 111.572 -175.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.476 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.6 tm? -79.55 -21.92 44.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.279 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 118' ' ' LEU . 37.7 p -87.7 24.09 1.81 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.242 -173.827 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.686 ' HB3' HD21 ' A' ' 100' ' ' LEU . 32.5 mt-10 -156.07 149.56 24.76 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.44 ' SG ' HD22 ' A' ' 74' ' ' LEU . 74.8 m -151.31 139.44 20.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.04 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.484 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 12.5 m-30 -118.72 121.59 40.46 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.89 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ASP . . . . . 0.934 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.0 OUTLIER -84.5 145.12 28.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.106 178.915 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -58.6 -31.81 68.4 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 124.649 1.218 . . . . 0.0 111.835 -171.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 16.8 mt -69.36 -40.5 77.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.568 -177.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 141.75 43.6 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.766 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.875 ' HB3' ' HB3' ' A' ' 110' ' ' ASP . 1.8 t-20 -109.14 152.49 25.04 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.287 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.484 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 38.6 ttp180 -134.73 128.03 32.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.785 0.326 . . . . 0.0 110.31 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -117.37 137.97 52.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.808 177.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -122.29 119.45 31.18 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.502 ' HB2' ' O ' ' A' ' 106' ' ' THR . 4.0 mm? -95.53 115.34 65.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -170.384 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.561 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 33.7 Cg_exo -69.21 155.2 68.46 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 124.169 3.246 . . . . 0.0 113.622 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.02 HG22 ' HE1' ' A' ' 39' ' ' TRP . 11.1 m -72.69 -23.02 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 114.75 -1.114 . . . . 0.0 112.631 -171.321 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.561 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.6 p90 -55.95 -29.69 60.55 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -168.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.6 t -99.32 -1.71 38.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.598 0.237 . . . . 0.0 111.34 -175.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.3 mt -133.85 -71.38 0.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.975 -174.328 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.701 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -118.76 116.06 34.83 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.606 -170.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 83.0 Cg_endo -104.16 32.61 0.06 OUTLIER 'Trans proline' 0 CA--C 1.556 1.582 0 C-N-CA 123.045 2.497 . . . . 0.0 116.539 177.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.73 -19.61 18.37 Favored 'Trans proline' 0 C--N 1.367 1.506 0 CA-C-N 121.945 1.73 . . . . 0.0 111.68 172.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.666 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.377 0 CA-C-O 121.471 0.653 . . . . 0.0 109.921 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.641 ' O ' ' HB ' ' A' ' 99' ' ' THR . 8.8 mtt180 . . . . . 0 CA--C 1.519 -0.217 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.564 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 8.7 p30 -109.67 161.51 15.32 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -176.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.606 ' HA ' ' HA2' ' A' ' 103' ' ' GLY . 26.2 tt0 -79.67 109.27 11.25 Favored Pre-proline 0 CA--C 1.534 0.331 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -165.281 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.939 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 73.2 Cg_endo -76.63 -165.29 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.335 2.69 . . . . 0.0 111.425 171.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.649 HD23 ' HE3' ' A' ' 34' ' ' LYS . 17.9 tp -48.33 138.06 10.38 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.189 0.518 . . . . 0.0 111.119 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.831 ' HG2' ' HB2' ' A' ' 105' ' ' LEU . 0.4 OUTLIER -76.9 94.15 3.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.874 -172.136 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.649 ' HE3' HD23 ' A' ' 32' ' ' LEU . 32.8 mmtp -98.68 -42.28 7.31 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.479 ' HG2' ' HZ3' ' A' ' 38' ' ' LYS . 9.4 tp10 -68.66 156.45 38.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.638 0.732 . . . . 0.0 112.543 -169.896 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.491 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 35.7 mmtm -95.08 160.93 29.82 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.251 -179.593 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.774 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 20.6 Cg_exo -66.44 138.37 50.2 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.239 1.959 . . . . 0.0 112.41 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.704 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 3.7 mtmt -110.76 148.98 31.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.847 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 1.029 ' HE1' HG22 ' A' ' 120' ' ' VAL . 0.8 OUTLIER 125.64 -4.52 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.105 0 O-C-N 126.047 2.092 . . . . 0.0 108.945 -171.186 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.543 ' HD2' ' O ' ' A' ' 41' ' ' SER . 0.0 OUTLIER -115.94 151.9 34.5 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.563 -167.466 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.543 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 58.4 m -64.98 149.08 50.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.456 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -56.81 -50.57 71.98 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -139.22 102.6 7.38 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.548 171.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.524 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 15.0 Cg_exo -67.88 131.63 24.53 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.077 1.851 . . . . 0.0 109.828 172.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.76 -81.3 0.33 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.742 -175.417 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 43.1 p -115.17 -175.52 2.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.894 178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.13 -36.53 79.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.788 0.328 . . . . 0.0 111.133 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.543 ' O ' ' HG2' ' A' ' 51' ' ' ARG . . . -63.07 -42.14 99.64 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.881 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -68.16 -37.7 81.3 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 1.4 tt -59.47 -55.33 35.97 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.029 178.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.543 ' HG2' ' O ' ' A' ' 48' ' ' GLY . 5.9 ptp180 -58.7 -46.99 86.07 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.754 0.311 . . . . 0.0 111.756 -176.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.47 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 74.2 m -67.35 -52.06 44.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.171 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -66.64 -32.67 74.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.242 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 54' ' ' ARG . 11.0 ttm180 -55.41 -48.29 74.6 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.22 -47.99 77.56 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.654 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 52' ' ' SER . 59.8 mt-10 -52.64 -48.47 66.39 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.762 177.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -66.1 -40.33 90.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.574 178.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.449 ' HA ' ' HB3' ' A' ' 61' ' ' ALA . 7.1 m95 -54.1 -31.36 51.81 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 177.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -66.96 -19.07 65.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.855 0.359 . . . . 0.0 111.27 176.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.8 m -108.27 -16.46 14.24 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.603 0.716 . . . . 0.0 110.224 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.844 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -76.88 169.61 20.34 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.303 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.844 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 36.0 Cg_endo . . . . . 0 C--N 1.346 0.439 0 C-N-CA 122.546 2.164 . . . . 0.0 113.069 -176.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.806 0 N-CA-C 112.722 -0.151 . . . . 0.0 112.722 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.614 ' HB2' HG22 ' A' ' 70' ' ' ILE . 5.3 mmp_? -143.36 126.62 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 122.72 0.408 . . . . 0.0 109.992 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -71.02 -26.82 63.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.084 0.469 . . . . 0.0 110.072 176.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.402 ' OE2' ' HD3' ' A' ' 67' ' ' ARG . 2.3 mp0 -60.53 -43.1 97.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.945 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.844 HD12 ' HB2' ' A' ' 110' ' ' ASP . 0.0 OUTLIER -80.8 -23.42 10.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.189 -176.637 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.558 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 2.0 m95 -52.5 -37.11 56.62 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -177.33 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -58.11 -35.36 71.33 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.278 0.361 . . . . 0.0 111.08 -177.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.25 -29.85 57.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.108 0.48 . . . . 0.0 110.555 -178.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.504 HD21 ' CD1' ' A' ' 70' ' ' ILE . 16.8 mt -67.72 -53.4 27.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.185 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.7 ptpt -65.13 -30.42 71.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.898 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.84 -36.97 76.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.103 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.08 -50.38 48.86 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.601 0.239 . . . . 0.0 110.438 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -31.92 61.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.419 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 24.5 t60 -63.78 -47.37 81.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 109.846 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -70.99 -52.37 20.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.827 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.568 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 21.0 t80 -57.28 -35.14 69.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.486 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.06 -27.13 68.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.943 0.401 . . . . 0.0 111.322 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -94.97 22.11 6.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.28 177.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 77.02 0.96 3.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.648 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.777 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 2.0 m-20 -77.46 84.37 3.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.321 0.581 . . . . 0.0 110.705 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 33' ' ' LYS . 98.8 m-70 -71.92 -39.68 69.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.947 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.82 -37.71 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.385 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.777 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -62.99 -51.22 67.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.931 0.396 . . . . 0.0 110.768 -179.846 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.806 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -62.34 -46.43 88.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.576 -175.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -63.79 -34.46 77.96 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.59 0.233 . . . . 0.0 110.528 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.17 -26.61 62.15 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.918 0.39 . . . . 0.0 110.557 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.8 mt -72.01 -47.06 56.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 174.404 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.649 HG23 HG22 ' A' ' 98' ' ' ILE . 9.7 mm -49.8 -61.83 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.529 173.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.166 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.56 -23.9 70.71 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.44 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 98' ' ' ILE . . . -99.97 9.27 43.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.154 -178.023 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 62.6 t30 69.85 11.93 7.85 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.83 1.3 . . . . 0.0 108.882 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.649 HG22 HG23 ' A' ' 93' ' ' ILE . 51.2 mt -83.88 141.0 15.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 113.343 -1.753 . . . . 0.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.641 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 30.0 p -134.5 168.6 18.66 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.101 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.536 HD21 ' C ' ' A' ' 107' ' ' GLU . 4.0 mt -150.2 106.5 3.17 Favored Pre-proline 0 N--CA 1.449 -0.506 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.05 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.525 ' HD2' ' CD2' ' A' ' 109' ' ' TYR . 24.9 Cg_endo -63.14 -26.36 72.89 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 121.431 1.421 . . . . 0.0 110.574 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -77.23 -20.89 54.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.798 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLY . . . . . 0.939 ' HA3' ' HD2' ' A' ' 31' ' ' PRO . . . 55.96 38.26 74.27 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 114.819 -1.082 . . . . 0.0 114.18 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.434 ' O ' HD13 ' A' ' 100' ' ' LEU . . . -110.93 149.21 30.97 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.756 0.313 . . . . 0.0 110.978 -177.019 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.831 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.84 -24.41 44.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.909 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.774 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 47.4 p -85.21 26.82 0.85 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.583 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.536 ' C ' HD21 ' A' ' 100' ' ' LEU . 20.1 mt-10 -165.48 156.98 14.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.261 175.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.507 ' HA ' HD21 ' A' ' 100' ' ' LEU . 86.9 m -156.22 139.86 15.99 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 172.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.525 ' CD2' ' HD2' ' A' ' 101' ' ' PRO . 18.3 m-30 -116.87 121.98 43.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.972 0.891 . . . . 0.0 110.266 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ASP . . . . . 0.879 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 3.5 t70 -80.48 149.07 30.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.249 -177.518 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -59.66 -25.97 65.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.933 -1.03 . . . . 0.0 112.714 -168.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -74.8 -9.6 58.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.208 0.528 . . . . 0.0 110.642 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.16 26.04 6.17 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.95 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.879 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 64.5 m-80 -94.73 150.24 20.41 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.425 ' HA ' ' HD1' ' A' ' 109' ' ' TYR . 10.3 ptp180 -123.37 144.69 49.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.045 0.45 . . . . 0.0 109.881 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -136.01 142.45 44.47 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.155 174.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.506 ' HA ' ' HG2' ' A' ' 107' ' ' GLU . 45.7 mt-30 -122.31 119.9 32.49 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.403 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 0.2 OUTLIER -85.67 112.5 45.13 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.45 -171.658 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.556 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 37.0 Cg_exo -69.16 154.71 69.68 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.586 2.857 . . . . 0.0 113.404 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.029 HG22 ' HE1' ' A' ' 39' ' ' TRP . 32.6 m -61.52 -16.82 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.94 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.556 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.7 p90 -59.24 -21.02 58.91 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -169.07 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 20.6 t -126.88 14.44 7.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.013 0.435 . . . . 0.0 110.688 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.706 HD13 HG22 ' A' ' 106' ' ' THR . 65.7 mt -132.54 -53.04 0.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.949 0.404 . . . . 0.0 111.902 -176.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.582 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -128.05 114.88 20.33 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-O 120.712 0.291 . . . . 0.0 110.953 -173.395 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.434 ' N ' ' CD ' ' A' ' 126' ' ' PRO . 75.6 Cg_endo -96.99 16.21 0.7 Allowed 'Trans proline' 0 CA--C 1.558 1.719 0 C-N-CA 123.012 2.475 . . . . 0.0 117.162 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.582 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 39.9 Cg_endo -68.66 -16.32 42.13 Favored 'Trans proline' 0 C--N 1.371 1.742 0 CA-C-N 122.486 1.924 . . . . 0.0 111.656 173.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.633 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.202 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.687 HH11 ' HB3' ' A' ' 29' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 121.426 0.631 . . . . 0.0 110.401 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.687 ' HB3' HH11 ' A' ' 28' ' ' ARG . 4.9 p-10 -97.28 160.33 14.39 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.753 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -81.37 106.29 5.57 Favored Pre-proline 0 C--N 1.326 -0.431 0 O-C-N 123.589 0.555 . . . . 0.0 112.36 -169.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.704 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 91.4 Cg_endo -79.59 -164.99 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 123.284 2.656 . . . . 0.0 111.222 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.2 mp -50.58 137.65 19.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.785 0.326 . . . . 0.0 110.757 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.721 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -75.43 100.62 4.53 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.375 1.083 . . . . 0.0 111.201 -171.007 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -98.4 -19.14 17.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.228 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.774 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 4.0 tp10 -95.67 149.26 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.091 0.472 . . . . 0.0 110.751 -174.168 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -98.73 161.47 24.91 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.617 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.662 ' HG3' HG21 ' A' ' 106' ' ' THR . 32.0 Cg_exo -55.58 142.23 81.98 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.617 2.211 . . . . 0.0 112.995 -177.286 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.644 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 36.2 ttpt -111.54 135.69 51.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.384 -170.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 1.043 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.4 p-90 152.01 -17.25 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.792 1.307 . . . . 0.0 110.961 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.474 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.41 164.51 13.51 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.573 0.225 . . . . 0.0 110.881 -174.664 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 39.7 m -65.27 119.73 11.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.839 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -67.5 -28.76 68.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -126.18 89.77 51.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.369 167.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.16 137.12 13.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.973 2.449 . . . . 0.0 112.262 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.42 ' HB3' ' H ' ' A' ' 46' ' ' THR . 12.4 mmm -108.03 -137.64 0.37 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 174.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.42 ' H ' ' HB3' ' A' ' 45' ' ' MET . 47.5 p -81.03 -175.19 5.28 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.783 -177.204 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.488 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 21.0 t70 -56.69 -49.58 74.69 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -168.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.07 -36.14 91.85 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.706 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -72.37 -44.17 62.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 0.0 110.263 175.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.458 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 50.6 tp -60.3 -45.52 93.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.807 -178.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 12.4 ptp180 -64.68 -50.84 65.42 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.463 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 26.7 t -64.07 -57.38 9.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.693 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 57' ' ' PHE . 2.0 tppt? -63.99 -28.05 69.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.138 -174.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 40.5 ttm180 -58.1 -45.65 86.86 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 172.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.2 -49.32 61.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 2.0 mp0 -50.36 -47.36 56.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.541 0.686 . . . . 0.0 110.495 174.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -69.4 -38.81 78.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.832 -179.246 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.483 ' CE3' ' HB3' ' A' ' 61' ' ' ALA . 2.3 m95 -53.2 -29.48 32.24 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.435 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 9.4 t70 -58.15 -27.16 63.54 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.492 0.663 . . . . 0.0 110.767 172.499 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.9 m -105.59 13.16 30.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.542 0.687 . . . . 0.0 110.096 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 1.003 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -99.33 175.81 2.26 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 1.003 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 31.6 Cg_endo . . . . . 0 C--N 1.365 1.419 0 C-N-CA 124.657 3.571 . . . . 0.0 116.001 -170.143 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.582 0 N-CA-C 111.555 -0.618 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.682 ' O ' HG22 ' A' ' 70' ' ' ILE . 4.0 mmp_? -108.74 96.13 6.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 110.54 -0.17 . . . . 0.0 110.54 177.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.545 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 16.7 tptm -45.74 -35.09 4.03 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.222 0.609 . . . . 0.0 111.726 178.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.447 ' H ' ' HG3' ' A' ' 69' ' ' GLU . 20.5 mt-10 -50.57 -40.25 51.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.12 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.682 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.9 OUTLIER -82.83 -22.1 9.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -175.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.545 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.09 -40.18 14.7 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 122.866 0.467 . . . . 0.0 111.881 -171.932 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.91 -36.84 70.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.581 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.61 -26.04 45.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.159 0.504 . . . . 0.0 110.296 -176.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.587 HD21 HD13 ' A' ' 70' ' ' ILE . 51.4 mt -70.29 -46.31 64.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.611 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 0.4 OUTLIER -72.71 -25.85 61.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.716 177.179 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -68.26 -39.67 82.14 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.726 0.298 . . . . 0.0 110.702 174.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -65.8 -47.35 75.4 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.483 176.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.674 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -49.96 -39.65 41.33 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.597 171.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 22.3 t60 -62.33 -47.69 83.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.224 -178.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -65.12 -53.95 37.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 177.11 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.599 ' HE1' ' HE3' ' A' ' 33' ' ' LYS . 9.6 t80 -53.94 -30.51 46.84 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.423 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.674 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.0 mt-10 -56.64 -40.66 75.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 175.063 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -84.96 20.34 1.88 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.463 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.7 t30 71.59 9.65 6.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.217 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.629 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 2.5 t0 -80.79 83.77 6.47 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.489 0.661 . . . . 0.0 110.536 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -72.56 -41.55 65.61 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.094 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.08 -43.8 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.286 -176.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.483 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.0 mt -55.58 -52.79 62.57 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 120.802 0.334 . . . . 0.0 110.771 175.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.632 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -61.74 -47.3 85.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.792 -176.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -27.67 65.71 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.61 -177.781 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -74.76 -32.56 62.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.846 0.355 . . . . 0.0 110.254 176.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.3 mt -68.76 -57.2 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.349 176.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -51.03 -61.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.208 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.41 ' HA ' ' O ' ' A' ' 98' ' ' ILE . 21.1 t70 -71.33 -18.25 62.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.252 -174.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.96 -11.52 70.02 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.121 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -108.93 8.68 26.52 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.097 -0.061 . . . . 0.0 111.029 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.1 m-80 72.95 4.34 4.94 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.313 0.578 . . . . 0.0 110.392 -173.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 1.101 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -83.73 134.88 25.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.736 172.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 21.3 p -138.97 166.36 24.69 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.772 -177.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.87 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.4 tm? -148.12 104.34 3.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.743 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.527 ' HD2' HD22 ' A' ' 100' ' ' LEU . 32.1 Cg_endo -63.81 -30.54 68.5 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.195 2.597 . . . . 0.0 113.779 -173.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -68.29 -9.55 48.45 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.67 0.272 . . . . 0.0 111.671 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLY . . . . . 0.721 ' O ' ' HA ' ' A' ' 33' ' ' LYS . . . 73.49 18.29 79.34 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.328 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.87 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -95.01 140.31 30.15 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.511 0.672 . . . . 0.0 111.373 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.652 HD11 ' HA ' ' A' ' 78' ' ' ALA . 2.5 tm? -83.15 -16.34 47.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.184 175.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.662 HG21 ' HG3' ' A' ' 37' ' ' PRO . 59.8 p -91.07 14.99 12.51 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.05 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 28.9 mt-10 -149.84 144.71 26.14 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 78.9 m -150.86 138.33 19.56 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 175.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.434 ' CD1' ' HG2' ' A' ' 115' ' ' ARG . 16.3 m-30 -116.93 122.5 44.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.511 0.672 . . . . 0.0 109.533 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ASP . . . . . 1.101 ' HA ' HG13 ' A' ' 98' ' ' ILE . 2.6 t70 -81.38 148.29 29.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.021 -173.43 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -55.26 -27.74 48.56 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 124.551 1.157 . . . . 0.0 112.645 -171.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.4 mt -78.95 -7.37 57.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.944 0.402 . . . . 0.0 110.874 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 23.44 7.27 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.182 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.994 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 59.1 m-80 -92.58 161.63 14.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.779 0.323 . . . . 0.0 110.904 -176.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.434 ' HG2' ' CD1' ' A' ' 109' ' ' TYR . 78.0 mtt180 -129.82 128.13 41.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.07 0.462 . . . . 0.0 111.187 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' TYR . . . . . 0.589 ' HE1' ' H ' ' A' ' 67' ' ' ARG . 20.2 m-85 -117.98 124.06 47.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.715 171.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -123.88 121.14 34.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.048 -171.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.59 HD23 HG22 ' A' ' 106' ' ' THR . 38.0 tp -98.99 119.82 59.96 Favored Pre-proline 0 C--N 1.319 -0.757 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -170.231 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.627 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 24.5 Cg_exo -69.38 156.2 65.03 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.313 2.675 . . . . 0.0 112.739 174.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.043 HG22 ' HE1' ' A' ' 39' ' ' TRP . 33.7 m -66.81 -15.79 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.273 -175.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.627 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.3 p90 -58.67 -21.65 54.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.944 0.402 . . . . 0.0 111.865 -172.327 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 37.0 t -101.61 2.4 38.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.179 -175.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 61.9 mt -139.6 -52.05 0.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.821 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.455 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -137.37 114.37 9.67 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.991 -173.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 88.5 Cg_endo -103.3 27.19 0.1 OUTLIER 'Trans proline' 0 CA--C 1.555 1.556 0 C-N-CA 122.973 2.448 . . . . 0.0 117.043 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.524 ' HD2' HD13 ' A' ' 127' ' ' ILE . 80.7 Cg_endo -81.35 -19.04 8.09 Favored 'Trans proline' 0 C--N 1.365 1.428 0 CA-C-N 122.268 1.846 . . . . 0.0 112.205 173.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.773 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 121.257 0.551 . . . . 0.0 110.442 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.751 ' O ' ' HB ' ' A' ' 99' ' ' THR . 22.1 mmm180 . . . . . 0 N--CA 1.446 -0.669 0 CA-C-O 121.081 0.467 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.415 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 28.0 p-10 -90.11 156.38 18.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.337 -174.103 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.692 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 9.0 pt20 -90.46 117.26 67.87 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -169.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.615 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.0 Cg_exo -70.18 -163.59 0.12 Allowed 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.959 3.106 . . . . 0.0 112.172 170.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.25 139.01 15.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.857 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.925 ' HZ2' ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -107.47 104.98 14.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.713 -170.057 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.579 ' HD3' ' O ' ' A' ' 34' ' ' LYS . 11.8 tmtt? -99.14 -24.12 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.51 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.611 ' OE1' ' HB3' ' A' ' 102' ' ' HIS . 44.3 mt-10 -71.39 167.4 19.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.524 0.678 . . . . 0.0 112.226 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' N ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -105.86 152.9 40.34 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.328 -166.22 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.76 ' HG3' HG21 ' A' ' 106' ' ' THR . 24.8 Cg_exo -62.01 144.88 96.74 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.021 2.481 . . . . 0.0 111.913 177.003 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.508 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 18.3 ttpp -112.22 115.88 29.53 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -168.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 1.008 ' HE1' HG12 ' A' ' 120' ' ' VAL . 1.1 p-90 170.71 20.84 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 113.2 -1.818 . . . . 0.0 109.966 173.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.567 ' HD2' ' O ' ' A' ' 41' ' ' SER . 1.6 tmmt? -128.34 147.97 50.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.04 0.448 . . . . 0.0 110.733 -159.563 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.567 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 58.2 m -64.62 140.31 58.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.571 -175.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.97 -39.36 74.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.678 175.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -140.99 92.22 8.68 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.053 171.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.553 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 7.4 Cg_exo -72.42 134.58 22.85 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.477 2.118 . . . . 0.0 110.502 175.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.1 ttp -112.66 -86.12 0.57 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.254 -175.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 46.4 p -117.67 -173.81 2.5 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.468 ' OD2' ' HD2' ' A' ' 51' ' ' ARG . 16.5 t70 -49.44 -44.87 45.87 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.866 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -53.19 -42.79 63.22 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.286 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 14.0 mm100 -72.23 -41.96 66.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.722 0.296 . . . . 0.0 110.333 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.75 -57.37 13.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.159 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.468 ' HD2' ' OD2' ' A' ' 47' ' ' ASP . 12.0 ptm180 -63.64 -45.52 89.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.494 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 31.1 t -65.41 -53.79 37.97 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.846 -176.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -65.77 -35.22 80.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.963 -179.363 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.44 ' HG3' ' CZ3' ' A' ' 39' ' ' TRP . 59.5 ttp180 -56.07 -46.5 78.96 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.435 0.159 . . . . 0.0 110.928 178.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.11 -52.7 46.22 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 120.998 0.428 . . . . 0.0 110.678 -177.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -55.76 -49.7 72.4 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.17 -45.27 81.51 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.564 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.423 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -50.14 -36.62 30.73 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.286 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -54.94 -41.02 70.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.724 0.297 . . . . 0.0 111.542 175.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -113.08 10.59 18.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.187 0.518 . . . . 0.0 111.376 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.751 ' O ' ' HB2' ' A' ' 117' ' ' GLN . . . -66.55 -60.18 6.97 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-O 119.085 -0.484 . . . . 0.0 111.047 -177.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.728 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 95.9 Cg_endo . . . . . 0 C--N 1.352 0.75 0 C-N-CA 121.876 1.717 . . . . 0.0 111.712 176.362 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.761 0 N-CA-C 113.824 0.289 . . . . 0.0 113.824 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.616 ' HD3' ' OD2' ' A' ' 110' ' ' ASP . 7.8 ttt180 -99.5 113.81 26.41 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 122.894 0.478 . . . . 0.0 109.758 -173.229 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.456 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 72.9 mmtt -75.64 -26.65 57.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -58.09 -37.16 73.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.168 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.682 HD12 HG12 ' A' ' 98' ' ' ILE . 0.8 OUTLIER -82.97 -22.01 8.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.553 -179.41 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.56 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -47.28 -41.73 19.44 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -172.83 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.566 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 11.9 m-20 -56.44 -31.29 63.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.08 -33.13 50.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.024 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.523 HD21 HD13 ' A' ' 70' ' ' ILE . 26.3 mt -70.55 -45.45 65.42 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.527 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 14.1 ptpt -68.9 -33.08 73.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.776 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -67.32 -36.05 80.67 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.954 0.407 . . . . 0.0 110.659 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.501 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -69.92 -48.99 56.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.708 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -52.6 -33.96 48.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.503 173.151 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.413 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 29.5 t60 -65.95 -51.36 59.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.509 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.14 -46.7 82.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.676 177.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -59.43 -33.61 71.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.241 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.46 -38.44 84.21 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.304 0.573 . . . . 0.0 110.823 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 22.7 t -85.72 21.31 1.9 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.322 -177.316 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 83' ' ' SER . 16.5 m120 73.82 0.43 3.63 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.838 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.653 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 14.8 m-20 -79.07 83.31 5.16 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.687 0.756 . . . . 0.0 110.314 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 58.6 m80 -71.9 -40.59 68.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.28 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.616 ' HA ' ' HG2' ' A' ' 90' ' ' GLN . 5.3 pt-20 -74.46 -31.52 62.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.26 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.653 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 10.1 mt -58.87 -51.55 69.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.174 0.511 . . . . 0.0 110.204 173.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.551 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -62.41 -44.23 96.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.001 -175.591 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.616 ' HG2' ' HA ' ' A' ' 87' ' ' GLU . 3.4 pt20 -66.88 -33.31 75.32 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.729 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.23 -26.24 61.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.855 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 88' ' ' LEU . 51.1 mt -74.15 -55.12 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 177.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.8 mm -52.18 -59.18 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.551 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.86 -27.26 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.709 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.78 -20.52 66.43 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.531 -0.758 . . . . 0.0 113.098 -177.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.542 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -84.48 -53.22 5.58 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.136 0.468 . . . . 0.0 110.21 179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.542 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.4 t-20 152.29 -28.29 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -175.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 1.015 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -57.66 145.38 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 112.44 -2.163 . . . . 0.0 111.734 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.751 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 33.7 p -132.74 165.47 24.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.568 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.845 HD22 ' HD2' ' A' ' 101' ' ' PRO . 2.3 tm? -150.84 113.51 3.16 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 173.053 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.845 ' HD2' HD22 ' A' ' 100' ' ' LEU . 13.2 Cg_endo -55.68 -42.14 70.47 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 124.012 3.141 . . . . 0.0 114.759 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.611 ' HB3' ' OE1' ' A' ' 35' ' ' GLU . 5.4 m-70 -72.66 -21.25 61.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -176.562 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLY . . . . . 0.615 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 86.15 17.12 61.55 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.933 -173.499 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.677 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -93.6 143.56 26.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.064 0.459 . . . . 0.0 110.971 -175.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.705 ' HB2' ' HG3' ' A' ' 33' ' ' LYS . 3.0 tm? -78.49 -32.03 48.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.779 -178.113 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.76 HG21 ' HG3' ' A' ' 37' ' ' PRO . 53.3 p -84.47 16.83 2.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.549 -172.458 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.603 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 41.1 mt-10 -148.5 140.95 24.28 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.091 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 76.8 m -152.19 145.14 24.45 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -118.67 122.8 43.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ASP . . . . . 1.015 ' HA ' HG13 ' A' ' 98' ' ' ILE . 12.6 t70 -80.92 148.41 29.87 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.236 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -57.5 -24.31 55.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.797 -1.092 . . . . 0.0 112.331 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.419 HD12 ' HD2' ' A' ' 67' ' ' ARG . 27.7 mt -79.23 -5.07 53.5 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.928 0.394 . . . . 0.0 110.949 -178.625 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.43 29.85 6.49 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.154 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.772 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 17.1 m120 -101.52 158.23 16.23 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.91 -0.171 . . . . 0.0 110.764 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -129.45 129.71 44.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.368 0.604 . . . . 0.0 110.762 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' TYR . . . . . 0.516 ' HE1' ' H ' ' A' ' 67' ' ' ARG . 17.3 m-85 -117.71 128.44 54.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.869 177.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.751 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 3.8 mm100 -123.21 127.23 48.33 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.511 HD23 HG22 ' A' ' 106' ' ' THR . 36.1 tp -98.75 124.24 46.73 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.385 -171.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.652 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 12.3 Cg_exo -72.82 155.04 53.93 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.33 2.687 . . . . 0.0 112.777 177.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.008 HG12 ' HE1' ' A' ' 39' ' ' TRP . 0.3 OUTLIER -76.45 -20.38 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 114.901 -1.045 . . . . 0.0 112.515 -171.244 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.652 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -57.08 -30.09 64.03 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.147 -171.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 46.9 t -94.51 -6.53 43.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.302 -173.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.495 HD12 ' HG3' ' A' ' 37' ' ' PRO . 94.6 mt -118.63 -54.12 2.28 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -175.492 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.432 ' HB3' HG22 ' A' ' 120' ' ' VAL . . . -117.67 111.75 39.33 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.154 0.502 . . . . 0.0 111.929 -172.357 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.37 -39.53 45.94 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 123.745 2.964 . . . . 0.0 115.862 176.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -42.69 -59.12 1.04 Allowed 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.658 2.239 . . . . 0.0 114.507 -175.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.844 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 120.894 0.378 . . . . 0.0 111.746 -176.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.593 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.0 ppt_? . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.238 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.715 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -93.39 156.73 16.61 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 171.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.425 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.9 OUTLIER -81.12 104.21 2.64 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -158.927 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.935 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 92.5 Cg_endo -78.87 -162.46 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 123.733 2.955 . . . . 0.0 111.839 172.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.561 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.1 mp -49.01 144.68 4.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.308 0.575 . . . . 0.0 112.044 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.547 ' HD2' ' N ' ' A' ' 33' ' ' LYS . 8.6 mptt -84.85 83.29 8.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.313 -178.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -97.68 -18.33 18.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.936 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.924 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 9.2 tp10 -87.16 159.73 18.77 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.223 0.535 . . . . 0.0 110.451 -177.711 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.48 ' HG2' ' OE2' ' A' ' 35' ' ' GLU . 16.6 pttm -99.99 155.13 36.79 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.109 -173.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.635 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 5.1 Cg_exo -73.97 143.28 32.57 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.302 2.001 . . . . 0.0 111.514 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.737 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 23.5 ttpp -110.88 145.69 37.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.225 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 1.103 ' HE1' HG22 ' A' ' 120' ' ' VAL . 0.9 OUTLIER 134.43 -3.68 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 O-C-N 125.227 1.579 . . . . 0.0 109.844 -172.937 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -113.48 158.73 20.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -167.199 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.448 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 25.0 m -65.23 125.26 24.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.524 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -61.91 -26.35 68.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.407 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -146.0 88.95 6.19 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.395 173.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PRO . . . . . 0.448 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 6.4 Cg_exo -75.4 137.34 20.72 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.924 2.416 . . . . 0.0 111.273 176.141 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 64.1 mtm -114.66 -75.39 0.59 Allowed 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -177.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 78.3 p -115.54 175.68 5.41 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.474 -0.491 . . . . 0.0 111.323 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.01 -41.89 97.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.015 0.436 . . . . 0.0 110.077 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.81 -44.3 87.07 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.697 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -68.67 -45.07 72.69 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -54.92 -47.47 74.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.797 -177.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.0 ptm180 -73.42 -39.44 65.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.604 0.24 . . . . 0.0 111.477 -176.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 m -68.82 -42.18 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 60.1 mmtt -71.58 -32.57 68.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.055 177.196 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -53.2 -48.46 68.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.088 0.471 . . . . 0.0 110.041 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.35 -52.58 64.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.99 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.79 -49.34 75.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.722 -1.127 . . . . 0.0 111.734 -177.048 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.404 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 42.6 m-85 -70.36 -37.16 74.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.744 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.18 -37.56 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 177.709 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -66.74 -20.29 65.93 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.826 0.346 . . . . 0.0 111.784 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 15.4 m -95.08 -11.87 27.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 109.659 178.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.465 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -86.0 158.23 56.12 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.424 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.465 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 19.3 Cg_endo . . . . . 0 C--N 1.346 0.435 0 C-N-CA 123.016 2.478 . . . . 0.0 113.749 -170.454 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.433 ' HA2' ' CE1' ' A' ' 116' ' ' TYR . . . . . . . . 0 N--CA 1.443 -0.835 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.679 ' O ' HG22 ' A' ' 70' ' ' ILE . 2.7 mmp_? -63.66 80.89 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 171.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.495 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 13.5 tptm -49.62 -37.82 29.5 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.897 0.479 . . . . 0.0 112.119 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.41 -40.74 62.51 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.186 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.679 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -84.32 -23.81 7.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.9 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.639 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -53.0 -38.49 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.259 -173.316 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.583 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 18.4 m-20 -62.49 -28.67 69.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.25 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.95 -27.58 39.75 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.519 0.676 . . . . 0.0 109.551 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.662 HD13 ' SG ' ' A' ' 108' ' ' CYS . 27.7 mt -74.71 -43.55 54.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.527 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.1 ptpt -70.53 -29.83 66.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.61 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.97 -38.29 72.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.767 175.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.64 -44.24 87.03 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.514 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -48.45 -41.14 28.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.694 170.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 29.7 t60 -62.26 -48.94 77.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.329 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -62.5 -53.03 60.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.622 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.522 ' HD2' HD22 ' A' ' 123' ' ' LEU . 20.6 t80 -55.47 -39.34 70.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.526 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.513 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.3 mt-10 -61.1 -33.75 73.87 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 8.1 t -87.57 20.11 3.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.159 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 83' ' ' SER . 3.4 m-20 73.44 4.8 4.89 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.751 0.82 . . . . 0.0 111.599 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.857 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 54.0 m-20 -82.35 84.1 7.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.825 0.821 . . . . 0.0 110.966 -179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.561 ' NE2' ' HA ' ' A' ' 32' ' ' LEU . 8.0 t-80 -69.03 -42.3 76.56 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.113 177.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.33 -33.75 71.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.146 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.857 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 7.0 mp -65.32 -56.32 13.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.975 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.616 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.67 -41.11 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.508 -176.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -69.35 -30.35 68.36 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.018 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.63 -21.99 51.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.938 0.399 . . . . 0.0 110.762 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 52.9 mt -77.93 -56.84 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.538 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 89' ' ' ALA . 10.1 mm -50.52 -60.67 0.79 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.122 176.42 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.02 -24.96 66.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.1 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.38 -16.74 73.78 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.859 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -97.99 5.59 48.64 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 122.718 -0.284 . . . . 0.0 110.893 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.6 t30 78.14 0.65 2.71 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.724 0.773 . . . . 0.0 109.76 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.943 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -89.71 144.92 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.426 177.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.593 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 22.7 p -140.62 171.1 14.58 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.456 -177.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.754 HD12 ' H ' ' A' ' 104' ' ' ALA . 1.6 tm? -148.59 103.36 3.46 Favored Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.13 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.525 ' HD2' HD22 ' A' ' 100' ' ' LEU . 21.2 Cg_endo -60.7 -25.13 80.38 Favored 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.763 2.975 . . . . 0.0 114.094 -174.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.556 ' H ' HD13 ' A' ' 100' ' ' LEU . 90.8 m-70 -76.26 -13.08 60.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.889 0.375 . . . . 0.0 110.402 177.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLY . . . . . 0.935 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 77.32 9.18 86.97 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.652 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.924 ' HB2' ' HB3' ' A' ' 35' ' ' GLU . . . -94.47 142.82 26.99 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.65 0.738 . . . . 0.0 111.612 -174.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.537 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.5 tm? -78.64 -14.23 59.42 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.225 -1.352 . . . . 0.0 107.792 173.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.635 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 25.4 p -84.24 6.85 21.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.153 -175.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -145.06 161.1 40.27 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.692 ' SG ' ' HB2' ' A' ' 116' ' ' TYR . 3.9 p -155.53 133.03 11.06 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.79 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.503 ' HA ' ' O ' ' A' ' 114' ' ' ASN . 19.4 m-30 -118.75 121.32 39.81 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.568 0.699 . . . . 0.0 109.573 177.148 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ASP . . . . . 0.943 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -87.29 152.27 22.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.773 -174.334 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.07 -25.47 63.79 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.854 -1.067 . . . . 0.0 112.645 -169.747 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.9 mt -79.05 -11.53 60.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.553 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.72 31.19 3.75 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.057 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.902 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 43.7 m-80 -96.11 145.09 25.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.689 0.281 . . . . 0.0 111.179 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.477 ' HA ' ' HD1' ' A' ' 109' ' ' TYR . 18.6 ptt180 -123.94 128.4 49.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.647 175.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' TYR . . . . . 0.692 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 35.3 m-85 -128.25 148.04 50.62 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 176.214 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 62' ' ' PRO . 9.3 mm100 -121.3 120.89 36.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.425 -173.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.723 HD12 ' HD2' ' A' ' 119' ' ' PRO . 13.9 tp -96.57 117.07 66.33 Favored Pre-proline 0 C--N 1.316 -0.868 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.584 -172.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.764 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 35.1 Cg_exo -62.51 154.99 60.87 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.821 3.014 . . . . 0.0 113.744 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.103 HG22 ' HE1' ' A' ' 39' ' ' TRP . 3.7 m -68.84 -16.49 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.223 -174.655 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.764 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.1 p90 -61.26 -18.28 57.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -169.879 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.5 t -121.06 14.54 11.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.059 -176.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.605 ' CD1' HG22 ' A' ' 106' ' ' THR . 95.8 mt -140.77 -52.22 0.47 Allowed 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.898 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.527 ' HB3' ' HB ' ' A' ' 120' ' ' VAL . . . -109.85 156.45 39.85 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.621 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.566 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 74.1 Cg_exo -53.3 -168.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.269 0 C-N-CA 123.618 2.879 . . . . 0.0 112.158 170.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.566 ' HD2' ' HB3' ' A' ' 125' ' ' PRO . 82.8 Cg_endo -69.74 13.51 0.28 Allowed 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.041 1.827 . . . . 0.0 112.654 -178.329 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.438 ' H ' ' C ' ' A' ' 125' ' ' PRO . 42.5 mm . . . . . 0 N--CA 1.455 -0.191 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.701 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.9 mmt85 . . . . . 0 CA--C 1.517 -0.303 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.617 ' HB2' ' OD2' ' A' ' 94' ' ' ASP . 3.3 p-10 -89.87 156.84 18.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.498 -175.092 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -84.52 109.76 22.22 Favored Pre-proline 0 C--N 1.325 -0.5 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -166.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.776 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 88.1 Cg_endo -79.1 -164.92 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.702 2.935 . . . . 0.0 111.467 169.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.04 149.24 19.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.385 0.612 . . . . 0.0 112.114 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.635 ' HE2' ' N ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -75.69 102.52 5.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.047 -172.436 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -97.29 -20.87 17.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.475 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.676 ' HB2' ' HB2' ' A' ' 104' ' ' ALA . 47.1 mt-10 -103.28 171.86 7.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.03 0.919 . . . . 0.0 113.266 -172.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.608 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 26.7 pttt -106.84 160.29 26.83 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 113.27 -1.786 . . . . 0.0 109.409 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.856 ' HG2' HG12 ' A' ' 120' ' ' VAL . 10.6 Cg_endo -61.58 139.29 80.63 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.266 1.977 . . . . 0.0 112.557 172.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.654 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 2.7 mtmt -112.14 147.81 35.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.198 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.99 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.9 p-90 132.27 -16.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.616 1.967 . . . . 0.0 108.289 -175.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.642 ' HG2' HG13 ' A' ' 127' ' ' ILE . 10.1 tppt? -113.45 153.69 28.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.365 -174.12 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 48.9 m -65.49 135.02 54.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.265 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -72.08 -27.34 62.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.69 175.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -131.78 81.99 61.67 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.108 170.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.43 130.11 16.83 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.603 2.202 . . . . 0.0 111.053 177.601 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.538 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.0 mtp -102.1 -87.64 0.4 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -174.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.1 p -118.78 179.09 4.24 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.365 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.517 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.7 t70 -54.66 -48.04 72.82 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.16 -35.15 82.98 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.232 -0.508 . . . . 0.0 112.608 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.695 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 31.3 mm-40 -70.13 -51.55 30.61 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 175.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.94 -47.97 76.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.808 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.649 ' HG3' ' N ' ' A' ' 52' ' ' SER . 13.6 ptp180 -62.9 -48.94 76.78 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.235 0.334 . . . . 0.0 111.586 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.649 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 24.3 t -68.46 -47.2 67.75 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -176.177 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.695 ' HB2' ' O ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -55.11 -44.45 74.99 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.512 173.897 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 62.0 ttt180 -60.77 -53.04 62.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.305 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.05 -49.93 74.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.77 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -51.97 -49.49 63.13 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.364 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.619 ' CD1' ' HA ' ' A' ' 39' ' ' TRP . 3.6 t80 -75.25 -38.91 60.3 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.581 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.504 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -53.99 -33.47 57.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.755 0.312 . . . . 0.0 111.338 -179.727 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.48 -25.85 68.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 0.0 111.566 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -109.13 -30.45 8.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.807 -172.048 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.654 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -49.49 -56.92 13.7 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -174.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 43.5 Cg_endo . . . . . 0 N--CA 1.458 -0.597 0 C-N-CA 122.19 1.927 . . . . 0.0 113.042 -177.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.722 ' HA2' ' HB3' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.442 -0.909 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.552 ' H ' ' HE2' ' A' ' 116' ' ' TYR . 7.3 ttt85 -159.85 133.41 7.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.85 0.357 . . . . 0.0 110.185 -175.079 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 71' ' ' TRP . 75.4 mmtt -77.66 -25.64 49.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.12 -175.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -57.9 -52.91 63.56 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.315 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.678 HD12 HG12 ' A' ' 98' ' ' ILE . 0.1 OUTLIER -68.37 -23.13 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.71 -178.499 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.546 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 1.8 m95 -50.99 -34.33 28.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 111.481 -178.324 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.751 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 17.2 t70 -56.89 -39.87 75.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.829 177.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.74 -27.08 60.99 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.227 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.512 HD11 ' SG ' ' A' ' 108' ' ' CYS . 24.6 mt -68.92 -43.65 74.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.751 ' HE2' ' HA ' ' A' ' 72' ' ' ASP . 8.4 mtmt -64.95 -46.3 82.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -57.74 -43.93 85.71 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.669 178.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.522 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -68.01 -52.31 37.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.725 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.488 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -50.0 -35.28 24.0 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 123.451 0.469 . . . . 0.0 110.462 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.508 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 21.4 t60 -60.68 -52.24 65.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.28 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -67.68 -52.53 36.84 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.705 177.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -51.31 -36.12 41.12 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.782 178.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -57.49 -39.22 75.99 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.183 0.516 . . . . 0.0 111.138 175.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.5 t -87.63 23.72 1.89 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.214 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 71.89 5.2 5.28 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.072 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.542 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 8.8 t0 -79.58 89.63 5.1 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.491 0.662 . . . . 0.0 110.418 -178.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -70.74 -35.82 72.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.008 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.577 ' HA ' HE21 ' A' ' 90' ' ' GLN . 9.4 pt-20 -70.22 -44.39 68.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.833 -170.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.448 ' O ' HG13 ' A' ' 92' ' ' ILE . 13.3 mt -60.65 -54.42 45.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.819 0.342 . . . . 0.0 111.316 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.499 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.71 -42.87 94.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.908 -174.246 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.577 HE21 ' HA ' ' A' ' 87' ' ' GLU . 25.8 pt20 -70.57 -32.89 70.46 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.68 -24.21 49.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 88' ' ' LEU . 41.2 mt -72.26 -57.7 6.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.391 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.504 ' CG2' HG22 ' A' ' 98' ' ' ILE . 9.6 mm -50.0 -57.49 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.839 174.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASP . . . . . 0.617 ' OD2' ' HB2' ' A' ' 29' ' ' ASN . 3.9 t70 -64.4 -31.53 72.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.852 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -74.36 -10.21 81.88 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.391 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.5 -0.68 51.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.681 -0.305 . . . . 0.0 110.415 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.8 t30 74.73 7.86 4.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 122.024 0.916 . . . . 0.0 109.071 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.97 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -87.38 137.09 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 114.455 -1.248 . . . . 0.0 108.74 172.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.701 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 40.1 p -120.37 166.09 14.01 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.218 -175.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.727 HD12 ' H ' ' A' ' 104' ' ' ALA . 1.6 tm? -149.47 101.44 3.3 Favored Pre-proline 0 N--CA 1.446 -0.658 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.666 176.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.613 ' HD2' HD22 ' A' ' 100' ' ' LEU . 26.4 Cg_endo -61.39 -16.79 49.43 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.801 3.001 . . . . 0.0 113.871 -172.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.669 ' H ' HD13 ' A' ' 100' ' ' LEU . 56.3 m-70 -82.83 -18.69 39.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.06 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLY . . . . . 0.776 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 80.01 9.98 86.08 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.98 -0.628 . . . . 0.0 112.386 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.727 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -98.84 148.2 24.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.259 0.552 . . . . 0.0 111.776 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.6 tm? -79.15 -17.67 54.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 174.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.85 HG22 HD13 ' A' ' 123' ' ' LEU . 52.4 p -87.57 21.18 2.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.019 -171.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.486 ' HB3' HD21 ' A' ' 100' ' ' LEU . 49.1 mt-10 -157.12 160.37 38.77 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.681 ' SG ' ' HB2' ' A' ' 116' ' ' TYR . 13.3 p -154.8 139.37 16.92 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.318 174.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.452 ' HD1' ' O ' ' A' ' 108' ' ' CYS . 11.8 m-30 -118.52 120.86 38.78 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.698 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ASP . . . . . 0.988 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 5.0 t70 -80.69 145.23 31.7 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.674 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -60.01 -22.28 62.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.868 -170.384 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.18 28.65 4.31 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.311 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.988 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 60.7 m-80 -98.97 158.65 15.51 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.984 -0.127 . . . . 0.0 110.796 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -139.34 139.65 37.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.331 . . . . 0.0 111.467 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' TYR . . . . . 0.681 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 27.6 m-85 -136.67 152.75 50.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.113 175.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.448 ' O ' ' HD3' ' A' ' 119' ' ' PRO . 10.2 mm100 -122.05 120.83 35.49 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.002 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.633 ' HB2' ' C ' ' A' ' 106' ' ' THR . 4.1 mm? -90.06 109.79 35.55 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-O 121.143 0.497 . . . . 0.0 111.512 -176.151 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.537 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 22.1 Cg_exo -74.74 156.09 44.18 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 124.152 3.235 . . . . 0.0 113.633 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.99 HG22 ' HE1' ' A' ' 39' ' ' TRP . 4.9 m -63.63 -16.68 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.735 -1.12 . . . . 0.0 113.178 -173.096 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.537 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.2 p90 -58.35 -23.54 57.14 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -169.618 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 39.4 t -129.84 27.35 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.096 0.474 . . . . 0.0 109.877 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.85 HD13 HG22 ' A' ' 106' ' ' THR . 95.1 mt -138.27 -50.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.917 -176.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -135.08 111.5 11.03 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 120.962 0.41 . . . . 0.0 111.833 -175.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.655 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 31.6 Cg_exo -61.51 -43.57 26.8 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.545 2.83 . . . . 0.0 115.271 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.655 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 16.3 Cg_exo -29.68 -56.87 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 124.866 3.711 . . . . 0.0 115.63 -174.142 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.941 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.402 0 CA-C-O 121.111 0.481 . . . . 0.0 111.853 -176.041 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 C--O 1.233 0.214 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.522 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 31.0 p-10 -99.31 159.61 14.88 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.851 -172.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.624 ' CD ' ' H ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -84.37 110.27 25.52 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.229 -165.149 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.566 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.6 Cg_exo -70.75 -162.91 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 124.056 3.171 . . . . 0.0 112.666 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.684 ' H ' HD12 ' A' ' 32' ' ' LEU . 6.5 mp -41.52 139.25 1.15 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.408 0.683 . . . . 0.0 112.798 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.981 ' HE2' ' HG2' ' A' ' 90' ' ' GLN . 2.3 mptp? -89.8 74.45 7.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.629 -176.039 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.92 -15.4 19.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.446 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.41 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 19.9 tt0 -77.03 156.91 31.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.491 0.662 . . . . 0.0 111.008 -178.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.425 ' H ' ' HG2' ' A' ' 36' ' ' LYS . 8.5 pttt -94.97 159.23 33.57 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.038 -172.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HB2' HG12 ' A' ' 120' ' ' VAL . 12.2 Cg_exo -68.86 144.83 60.34 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.055 1.837 . . . . 0.0 111.296 174.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.699 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 31.9 ttpt -111.04 145.19 38.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.303 -170.957 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 1.051 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.0 OUTLIER 134.75 -9.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 O-C-N 125.429 1.706 . . . . 0.0 109.775 -179.348 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.614 ' HG2' HG11 ' A' ' 120' ' ' VAL . 0.0 OUTLIER -113.61 168.89 9.38 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.386 0.612 . . . . 0.0 111.396 -171.049 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.2 m -85.82 133.13 33.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.287 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.3 -27.85 66.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.444 0.64 . . . . 0.0 109.338 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -141.43 84.4 12.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.892 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.49 144.36 60.83 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.825 2.35 . . . . 0.0 111.805 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.545 ' HB3' ' H ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -127.21 -135.25 0.24 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.279 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.545 ' H ' ' HB3' ' A' ' 45' ' ' MET . 69.0 p -73.1 170.05 15.73 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -171.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 20.4 t70 -55.15 -37.88 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.617 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.44 -36.59 63.97 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.109 177.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -75.42 -39.16 59.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.8 tp -58.66 -53.18 61.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.903 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 16.4 ptp180 -60.72 -46.83 88.9 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.082 -178.748 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 18.2 m -65.2 -47.66 76.14 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.947 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.594 ' C ' ' HD2' ' A' ' 53' ' ' LYS . 4.5 tmmm? -56.95 -45.75 82.59 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.135 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -53.5 -53.47 50.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.429 -174.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.1 -50.4 48.48 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.051 0.453 . . . . 0.0 111.147 -177.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 1.7 tm-20 -54.56 -49.87 69.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.836 -177.549 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.411 ' CE1' ' HG2' ' A' ' 53' ' ' LYS . 12.1 m-85 -71.48 -39.05 71.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.622 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.493 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 1.9 m95 -56.91 -23.08 42.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . 0.488 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 7.5 t70 -65.9 -37.24 85.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.858 0.361 . . . . 0.0 111.351 173.519 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.2 m -107.91 -22.08 12.58 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -169.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.598 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -60.46 -59.19 14.63 Favored Pre-proline 0 CA--C 1.538 0.512 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.272 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.598 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 88.0 Cg_endo . . . . . 0 C--N 1.349 0.56 0 C-N-CA 122.073 1.849 . . . . 0.0 112.953 -174.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.436 ' HA3' ' CZ ' ' A' ' 116' ' ' TYR . . . . . . . . 0 N--CA 1.44 -1.073 0 N-CA-C 111.421 -0.672 . . . . 0.0 111.421 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 67' ' ' ARG . 68.6 mmt-85 -102.9 116.69 33.03 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.411 ' HD2' ' OE1' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -77.63 -15.92 58.88 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.776 0.322 . . . . 0.0 110.807 -177.668 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.411 ' OE1' ' HD2' ' A' ' 68' ' ' LYS . 6.8 mp0 -60.57 -41.98 95.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.244 175.73 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.563 ' O ' HG12 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -82.98 -19.84 9.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.36 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.52 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -46.57 -41.42 14.41 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 122.569 0.348 . . . . 0.0 111.891 -176.241 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.504 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 10.4 m-20 -59.8 -32.63 70.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.18 -35.15 66.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.09 0.471 . . . . 0.0 109.919 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.419 HD21 HD13 ' A' ' 70' ' ' ILE . 25.4 mt -66.22 -48.65 69.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.594 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 14.3 ptpt -68.78 -28.03 66.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.855 179.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -73.2 -36.9 66.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.916 0.388 . . . . 0.0 110.672 176.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.67 -48.0 65.06 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.475 176.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -52.76 -34.3 52.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.826 172.055 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.414 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 35.4 t60 -64.4 -51.9 60.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.948 0.404 . . . . 0.0 109.929 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.438 ' HB1' ' HB2' ' A' ' 88' ' ' LEU . . . -64.1 -55.56 21.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.187 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -52.68 -34.81 53.64 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.642 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.012 0.434 . . . . 0.0 111.395 176.107 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 7.1 t -85.31 15.55 4.27 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.441 ' HB2' ' O ' ' A' ' 83' ' ' SER . 36.3 m-80 73.6 5.18 4.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.589 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 80' ' ' ALA . 1.7 m-20 -77.21 84.62 3.68 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.859 0.837 . . . . 0.0 110.584 176.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.662 ' HE2' ' HA ' ' A' ' 32' ' ' LEU . 12.6 t-80 -70.36 -39.59 74.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.256 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -60.28 -44.0 95.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.387 -178.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.441 ' O ' HG13 ' A' ' 92' ' ' ILE . 12.7 mt -63.71 -51.48 64.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.736 -177.425 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.588 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -60.55 -39.29 87.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.605 -175.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.981 ' HG2' ' HE2' ' A' ' 33' ' ' LYS . 9.2 mt-30 -65.46 -43.67 89.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.705 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -21.17 64.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.029 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.4 mt -82.12 -60.94 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.505 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 89' ' ' ALA . 9.3 mm -55.23 -54.34 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.829 0.347 . . . . 0.0 111.253 178.612 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.48 -33.19 75.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.273 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -69.97 -14.44 70.72 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.225 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -95.99 3.72 53.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 84.5 m-20 75.89 7.6 3.69 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.688 0.617 . . . . 0.0 109.621 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.915 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -89.94 139.47 17.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.036 -0.984 . . . . 0.0 109.831 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 p -124.26 162.74 23.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.222 0.535 . . . . 0.0 111.619 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.72 HD13 ' H ' ' A' ' 102' ' ' HIS . 1.7 tm? -150.1 109.83 3.25 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.463 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.631 ' HD2' HD22 ' A' ' 100' ' ' LEU . 38.0 Cg_endo -64.71 -24.01 62.61 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.185 2.59 . . . . 0.0 113.655 -172.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.72 ' H ' HD13 ' A' ' 100' ' ' LEU . 11.3 m170 -76.29 -18.75 58.81 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.784 0.325 . . . . 0.0 111.283 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLY . . . . . 0.566 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 80.51 11.68 83.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.702 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.581 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -93.29 152.02 19.43 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.297 0.57 . . . . 0.0 111.56 -173.439 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.885 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 2.8 tm? -84.89 -23.36 28.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.209 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.443 HG21 ' HG3' ' A' ' 37' ' ' PRO . 47.0 p -88.46 17.62 5.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.53 -174.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.604 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 66.4 mt-10 -150.5 143.21 24.57 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 81.8 m -152.01 139.24 19.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.886 0.374 . . . . 0.0 111.519 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.559 ' HE1' ' HG3' ' A' ' 115' ' ' ARG . 19.7 m-30 -118.94 122.02 41.27 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.469 0.652 . . . . 0.0 109.46 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ASP . . . . . 0.965 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.9 t70 -83.32 145.42 29.08 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.009 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.89 -27.49 60.68 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 124.451 1.095 . . . . 0.0 112.271 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.0 mt -76.47 -11.91 59.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.453 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.66 30.22 3.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.253 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.965 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 57.3 m-80 -98.76 157.92 15.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.744 0.307 . . . . 0.0 110.952 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.559 ' HG3' ' HE1' ' A' ' 109' ' ' TYR . 11.4 ttm180 -134.53 122.53 22.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 -174.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' TYR . . . . . 0.482 ' C ' HE21 ' A' ' 117' ' ' GLN . 38.5 m-85 -120.85 124.8 45.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.375 175.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.482 HE21 ' C ' ' A' ' 116' ' ' TYR . 2.3 mm-40 -122.34 121.37 36.55 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.523 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.489 HD23 HD11 ' A' ' 123' ' ' LEU . 21.5 tp -98.65 122.2 53.98 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -166.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.568 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 11.2 Cg_exo -74.84 157.38 43.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.974 3.116 . . . . 0.0 113.215 177.715 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.051 HG22 ' HE1' ' A' ' 39' ' ' TRP . 20.4 m -72.58 -10.03 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.798 -175.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.568 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.1 p90 -56.24 -24.11 40.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -170.407 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 52.2 t -113.4 3.53 15.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.74 0.305 . . . . 0.0 111.111 -176.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.489 HD11 HD23 ' A' ' 118' ' ' LEU . 20.0 mt -125.47 -53.61 1.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.848 0.356 . . . . 0.0 111.842 -174.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.623 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -136.15 111.59 10.13 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.691 0.281 . . . . 0.0 110.764 -176.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.511 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 11.1 Cg_endo -92.78 6.7 3.07 Favored 'Trans proline' 0 CA--C 1.559 1.764 0 C-N-CA 123.281 2.654 . . . . 0.0 117.379 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.623 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 17.4 Cg_endo -59.29 -31.57 95.32 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 122.921 2.079 . . . . 0.0 111.776 174.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.694 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.091 178.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 121.039 0.447 . . . . 0.0 111.231 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.493 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -101.08 157.96 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.349 176.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.788 ' HB3' ' HA2' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -87.19 117.67 68.92 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -168.829 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.784 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 13.4 Cg_exo -72.17 -163.4 0.14 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.227 2.618 . . . . 0.0 111.476 164.833 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.455 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.2 mp -59.99 142.86 53.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.808 0.337 . . . . 0.0 110.985 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.552 ' HE3' ' HB2' ' A' ' 86' ' ' HIS . 0.0 OUTLIER -78.02 71.98 4.52 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.274 0.559 . . . . 0.0 111.586 -178.993 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -87.29 -17.3 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.547 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.27 169.56 17.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.528 0.68 . . . . 0.0 111.729 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -108.62 149.72 39.8 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.215 -176.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.614 ' HG3' HG21 ' A' ' 106' ' ' THR . 22.9 Cg_exo -60.8 138.75 81.35 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.566 2.177 . . . . 0.0 111.665 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.506 ' HE2' ' HB3' ' A' ' 38' ' ' LYS . 3.4 tmmm? -111.17 122.47 47.96 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.891 0.853 . . . . 0.0 112.761 -170.49 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 1.047 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.9 p-90 175.04 23.26 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 113.058 -1.883 . . . . 0.0 108.159 172.491 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.601 ' HE2' HG12 ' A' ' 127' ' ' ILE . 1.8 tmmt? -142.24 149.55 39.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.444 -156.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.502 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 57.7 m -66.75 119.64 12.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.373 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -64.54 -25.56 68.04 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -130.16 83.6 62.66 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.592 171.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -70.03 141.38 43.96 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.636 2.224 . . . . 0.0 112.35 -178.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -116.75 -135.63 0.35 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 37.3 p -72.93 -179.88 3.4 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -65.68 -37.19 85.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.737 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.8 -38.82 96.71 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.026 -0.607 . . . . 0.0 111.633 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -71.68 -33.55 68.93 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.698 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 3.2 tm? -60.49 -52.7 64.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.322 178.16 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.48 ' HG3' ' N ' ' A' ' 52' ' ' SER . 6.6 ptm180 -65.1 -54.9 22.78 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -176.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.48 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 47.7 m -62.75 -50.9 69.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.421 -174.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.468 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 0.1 OUTLIER -67.94 -28.37 67.41 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.903 -177.718 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.698 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.2 -39.48 94.75 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.801 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.82 -48.32 66.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.243 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.03 -52.41 43.32 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.468 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 17.8 m-85 -59.97 -40.04 87.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.531 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -25.0 61.41 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -73.72 -32.47 63.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.115 0.483 . . . . 0.0 110.859 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 m -92.32 -23.43 19.26 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.324 -174.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.682 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -59.98 -67.02 1.15 Allowed Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.682 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 88.8 Cg_endo . . . . . 0 C--N 1.351 0.683 0 C-N-CA 121.52 1.48 . . . . 0.0 112.462 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLY . . . . . 0.506 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.794 0 N-CA-C 112.786 -0.126 . . . . 0.0 112.786 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.688 ' HB3' HG22 ' A' ' 70' ' ' ILE . 7.7 tpt180 -81.12 112.75 18.77 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.567 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 14.3 tptm -61.57 -33.02 73.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.915 0.388 . . . . 0.0 110.584 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.72 -45.18 82.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.62 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.688 HG22 ' HB3' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -77.27 -21.18 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.198 -177.507 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.567 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.32 -42.92 22.23 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.28 0.562 . . . . 0.0 111.208 -176.563 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASP . . . . . 0.549 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 7.9 m-20 -66.04 -25.57 67.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.894 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.6 -29.78 46.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.4 0.619 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.419 HD21 ' CD1' ' A' ' 70' ' ' ILE . 17.2 mt -70.19 -51.2 32.92 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.506 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.549 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 13.2 ptpt -64.89 -32.74 74.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.867 178.459 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.26 -35.57 73.88 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.752 0.311 . . . . 0.0 110.945 176.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -68.87 -46.91 67.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.484 176.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.572 ' HB1' HD21 ' A' ' 123' ' ' LEU . . . -52.59 -36.02 55.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.419 173.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.526 ' O ' ' HB2' ' A' ' 82' ' ' GLU . 63.6 t60 -62.98 -47.09 84.65 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.342 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.06 -51.32 59.26 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.56 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.551 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 1.8 t80 -54.04 -34.7 60.72 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.891 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 28.6 mt-10 -51.37 -48.72 62.43 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 175.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . 0.561 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 15.2 m -76.41 -19.69 57.85 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.731 -173.453 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' A' ' 83' ' ' SER . 9.7 t30 138.93 -17.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.226 0 O-C-N 124.947 1.405 . . . . 0.0 109.846 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.589 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 0.2 OUTLIER -71.73 90.63 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -165.106 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.704 ' O ' ' HG2' ' A' ' 90' ' ' GLN . 27.4 t-80 -70.45 -44.99 66.66 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.011 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLU . . . . . 0.508 ' H ' ' CD ' ' A' ' 87' ' ' GLU . 1.7 pm0 -62.96 -47.03 84.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.73 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.525 ' O ' HG13 ' A' ' 92' ' ' ILE . 4.2 mt -54.45 -56.36 19.52 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.251 0.548 . . . . 0.0 110.838 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.795 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -61.31 -42.64 99.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.766 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.704 ' HG2' ' O ' ' A' ' 86' ' ' HIS . 22.6 mm-40 -63.74 -38.45 91.14 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.171 -0.211 . . . . 0.0 111.18 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.77 -30.77 69.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.906 0.384 . . . . 0.0 110.284 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 88' ' ' LEU . 57.2 mt -69.71 -59.97 2.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.851 178.084 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.567 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.5 mm -52.4 -57.17 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.134 0.492 . . . . 0.0 111.005 178.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -64.56 -24.49 67.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.042 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.57 -19.2 68.78 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.697 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -101.53 4.24 40.89 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.692 -0.299 . . . . 0.0 110.603 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 3.7 m-20 72.9 8.11 5.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.565 0.698 . . . . 0.0 110.107 -174.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.968 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.6 mp -82.05 136.92 22.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.82 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.521 ' HA ' ' OE1' ' A' ' 30' ' ' GLN . 25.6 p -138.61 171.18 14.73 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.409 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.784 HD13 ' H ' ' A' ' 102' ' ' HIS . 1.5 tm? -148.52 114.33 3.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.582 ' HD2' HD22 ' A' ' 100' ' ' LEU . 34.7 Cg_endo -65.13 -17.62 59.32 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.492 2.795 . . . . 0.0 114.558 -174.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.784 ' H ' HD13 ' A' ' 100' ' ' LEU . 18.8 m-70 -79.93 -23.22 41.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.179 0.514 . . . . 0.0 111.033 177.887 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLY . . . . . 0.788 ' HA2' ' HB3' ' A' ' 30' ' ' GLN . . . 75.99 17.29 80.12 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.392 -0.909 . . . . 0.0 111.567 -172.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -94.96 141.38 28.72 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 121.168 0.509 . . . . 0.0 110.406 -176.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.795 HD21 ' HB1' ' A' ' 89' ' ' ALA . 0.3 OUTLIER -75.29 -21.63 58.34 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.9 -1.046 . . . . 0.0 109.005 179.122 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.614 HG21 ' HG3' ' A' ' 37' ' ' PRO . 64.4 p -90.71 15.05 11.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.936 -173.282 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.585 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.4 mt-10 -148.55 143.87 26.91 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 175.034 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.8 m -150.75 139.17 20.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.524 0.202 . . . . 0.0 110.523 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -118.92 123.16 43.96 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.343 0.592 . . . . 0.0 109.967 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ASP . . . . . 0.968 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.3 t70 -87.11 147.22 25.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.503 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.55 -24.71 57.63 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.112 -172.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.4 ' HG ' ' OD1' ' A' ' 110' ' ' ASP . 27.4 mt -76.71 -3.04 35.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 110.938 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.11 34.39 6.48 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 0.787 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 11.6 m120 -106.6 157.88 17.35 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -139.95 139.16 36.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.229 0.537 . . . . 0.0 110.942 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' TYR . . . . . 0.424 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 40.1 m-85 -124.91 127.75 47.57 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.921 175.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -121.38 122.52 40.01 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -176.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.456 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 30.8 tp -102.53 123.29 43.28 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.065 -167.915 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.653 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 20.4 Cg_exo -69.48 155.76 65.94 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.737 2.958 . . . . 0.0 112.751 176.138 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 1.047 HG22 ' HE1' ' A' ' 39' ' ' TRP . 20.2 m -66.17 -17.71 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.656 -175.167 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.653 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.3 p90 -60.65 -22.14 63.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -166.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.7 t -110.59 1.48 18.1 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.601 -174.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.572 HD21 ' HB1' ' A' ' 78' ' ' ALA . 90.3 mt -130.31 -37.02 1.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 0.0 111.808 -177.114 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.427 ' HB3' ' HB ' ' A' ' 120' ' ' VAL . . . -117.46 112.53 39.19 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.439 -175.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.552 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 51.3 Cg_exo -56.38 -34.91 95.51 Favored 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.648 2.899 . . . . 0.0 115.674 177.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 48.8 Cg_endo -67.31 -149.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.365 1.444 0 C-N-CA 121.778 1.652 . . . . 0.0 112.459 175.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.601 HG12 ' HE2' ' A' ' 40' ' ' LYS . 4.0 mp . . . . . 0 C--O 1.232 0.146 0 CA-C-O 122.383 1.087 . . . . 0.0 109.759 -174.251 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.633 ' O ' ' HB ' ' A' ' 99' ' ' THR . 10.8 mtm180 . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 121.036 0.446 . . . . 0.0 110.751 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.452 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 26.1 p-10 -91.1 156.75 17.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.621 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.877 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 3.7 pm0 -88.78 118.16 69.03 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 121.787 0.804 . . . . 0.0 112.219 -170.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.664 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 5.2 Cg_exo -77.4 -164.38 0.26 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.493 2.795 . . . . 0.0 111.435 169.517 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LEU . . . . . 0.537 ' HG ' ' NE2' ' A' ' 86' ' ' HIS . 7.7 tt -40.82 120.71 1.35 Allowed 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 173.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LYS . . . . . 0.779 ' HB3' ' H ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -56.83 121.75 10.6 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 121.473 0.654 . . . . 0.0 111.655 -177.426 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -95.2 -33.92 12.43 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.395 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.14 170.1 12.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.516 174.269 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -110.53 162.37 20.83 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.56 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PRO . . . . . 0.56 ' HB2' HG12 ' A' ' 120' ' ' VAL . 22.0 Cg_exo -59.98 123.26 12.83 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.625 1.55 . . . . 0.0 110.839 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 3.4 tmmm? -108.09 122.14 46.28 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.891 0.853 . . . . 0.0 112.207 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' TRP . . . . . 0.999 ' HE1' HG22 ' A' ' 120' ' ' VAL . 2.5 p-90 171.08 24.27 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.795 -2.002 . . . . 0.0 107.882 177.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.573 ' HD2' ' N ' ' A' ' 41' ' ' SER . 1.2 tmmt? -141.13 152.88 45.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.298 -153.742 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . 0.573 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 48.2 m -64.62 127.29 30.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.447 -177.219 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -61.72 -29.54 70.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.86 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -147.56 95.95 4.21 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.693 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.52 129.02 13.24 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.667 2.244 . . . . 0.0 111.866 176.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' MET . . . . . 0.633 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.6 mtp -94.27 -85.27 0.3 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.057 -179.193 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.0 p -114.85 -178.16 3.3 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.423 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 9.0 p-10 -69.22 -33.36 73.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.81 0.338 . . . . 0.0 110.336 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.71 -38.05 95.62 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.619 176.556 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.633 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 15.7 mm100 -70.94 -41.54 71.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.856 0.36 . . . . 0.0 110.181 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.74 -50.42 73.27 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.455 -179.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 7.2 ptm180 -66.51 -42.41 87.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.7 t -65.61 -52.08 54.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.924 0.392 . . . . 0.0 110.286 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.45 ' HG3' ' CE2' ' A' ' 57' ' ' PHE . 3.4 tppt? -63.1 -35.28 79.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.431 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -56.81 -46.94 81.29 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.902 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.48 -46.11 73.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.003 0.43 . . . . 0.0 110.86 -177.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -53.44 -49.57 67.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.799 175.396 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.45 ' CE2' ' HG3' ' A' ' 53' ' ' LYS . 19.0 m-85 -63.22 -43.91 96.76 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.1 176.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' TRP . . . . . 0.424 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 0.1 OUTLIER -49.6 -36.06 22.89 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 178.718 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -70.16 -26.12 63.77 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.6 m -96.12 -24.31 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.757 0.789 . . . . 0.0 109.821 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.539 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -68.32 159.18 82.02 Favored Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.405 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.539 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 21.4 Cg_endo . . . . . 0 N--CA 1.46 -0.45 0 C-N-CA 122.99 2.46 . . . . 0.0 112.713 -173.488 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.848 0 N-CA-C 111.576 -0.61 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 67' ' ' ARG . 37.7 mtt180 -65.89 109.75 2.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.962 0.41 . . . . 0.0 110.266 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.748 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 72.9 mmtt -64.84 -23.41 67.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.681 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLU . . . . . 0.401 ' HG3' ' H ' ' A' ' 69' ' ' GLU . 22.6 mt-10 -52.51 -53.63 43.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.031 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.772 HG13 HD13 ' A' ' 98' ' ' ILE . 0.0 OUTLIER -82.84 -25.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.668 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 71' ' ' TRP . . . . . 0.748 ' HB2' ' HA ' ' A' ' 68' ' ' LYS . 5.9 m95 -52.41 -35.95 53.14 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.053 177.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -55.68 -39.35 70.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.426 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.35 -28.76 37.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 110.382 -175.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.49 HD21 ' CD1' ' A' ' 70' ' ' ILE . 21.8 mt -64.65 -49.87 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.25 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.635 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 10.7 ptpt -73.43 -26.68 61.05 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.093 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -67.33 -41.11 85.77 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.895 0.379 . . . . 0.0 110.636 175.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -66.94 -50.93 60.82 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.206 176.121 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ALA . . . . . 0.586 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -51.29 -32.89 26.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.733 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' HIS . . . . . 0.488 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 65.5 t60 -62.56 -50.67 70.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.894 0.378 . . . . 0.0 110.468 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.08 -52.06 52.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.559 177.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.466 ' CE1' ' HD2' ' A' ' 33' ' ' LYS . 10.4 t80 -55.68 -26.79 46.65 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.32 178.215 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.586 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.0 mt-10 -57.22 -34.56 68.68 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.671 -0.643 . . . . 0.0 110.785 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.5 t -90.77 16.62 8.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.461 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.8 t30 70.68 8.52 6.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.397 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.58 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 11.0 t0 -76.07 93.37 3.3 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.784 -177.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' HIS . . . . . 0.641 ' O ' ' HG3' ' A' ' 90' ' ' GLN . 66.2 m80 -71.37 -50.79 28.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.777 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -58.61 -40.65 83.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.191 -171.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.535 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.8 mt -59.01 -52.48 65.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.89 0.376 . . . . 0.0 110.812 176.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.891 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -65.59 -40.02 92.22 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.467 -175.173 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' A' ' 86' ' ' HIS . 19.9 mt-30 -58.08 -46.59 85.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.468 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.15 -25.08 60.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.724 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 88' ' ' LEU . 46.4 mt -69.91 -59.43 3.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.641 0.258 . . . . 0.0 110.628 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ILE . . . . . 0.534 ' CG2' HG22 ' A' ' 98' ' ' ILE . 10.6 mm -53.04 -59.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.301 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -63.93 -25.26 68.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.364 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.97 56.11 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.622 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . 0.624 ' HB3' HD12 ' A' ' 98' ' ' ILE . . . -112.41 15.89 20.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 122.548 -0.384 . . . . 0.0 111.574 -179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 72.2 9.72 5.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 122.041 0.924 . . . . 0.0 108.948 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ILE . . . . . 0.772 HD13 HG13 ' A' ' 70' ' ' ILE . 50.3 mt -96.25 138.03 22.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.594 -176.208 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' THR . . . . . 0.633 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 34.3 p -139.13 168.66 19.34 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.227 -0.589 . . . . 0.0 112.178 -170.496 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' LEU . . . . . 0.92 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.7 tm? -149.38 99.62 3.39 Favored Pre-proline 0 N--CA 1.452 -0.354 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.086 174.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' PRO . . . . . 0.492 ' HD2' HD22 ' A' ' 100' ' ' LEU . 56.0 Cg_endo -66.68 -10.72 29.07 Favored 'Trans proline' 0 N--CA 1.475 0.383 0 C-N-CA 123.433 2.756 . . . . 0.0 113.29 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' HIS . . . . . 0.679 ' H ' HD13 ' A' ' 100' ' ' LEU . 48.8 m170 -84.02 -9.85 58.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.702 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLY . . . . . 0.664 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 67.84 38.15 89.03 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.623 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ALA . . . . . 0.92 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -122.67 139.39 54.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.287 0.565 . . . . 0.0 111.391 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.891 HD21 ' HB1' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -76.9 -22.08 53.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.043 -0.98 . . . . 0.0 108.412 176.625 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.578 HG22 HD13 ' A' ' 123' ' ' LEU . 59.1 p -91.84 18.11 8.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.606 -172.183 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.7 mt-10 -150.62 149.14 29.49 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 171.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.445 ' SG ' HD22 ' A' ' 74' ' ' LEU . 80.6 m -150.55 144.09 25.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.798 0.332 . . . . 0.0 110.416 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' TYR . . . . . 0.642 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 18.0 m-30 -118.48 121.73 40.99 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.093 0.473 . . . . 0.0 109.835 177.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ASP . . . . . 1.051 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.3 t70 -79.78 145.18 32.98 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.597 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -59.6 -24.47 63.82 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.967 -168.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 mt -76.82 -13.73 59.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.118 0.485 . . . . 0.0 110.495 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.23 28.05 3.2 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.452 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASN . . . . . 1.051 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 51.5 m-80 -94.1 143.01 26.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.794 0.297 . . . . 0.0 110.766 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.642 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 53.2 ttp180 -123.3 121.19 35.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.579 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -127.16 140.7 52.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.942 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' GLN . . . . . 0.458 ' O ' ' HG3' ' A' ' 62' ' ' PRO . 24.8 mt-30 -123.11 146.36 47.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.601 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 118' ' ' LEU . . . . . 0.706 HD12 ' HD2' ' A' ' 119' ' ' PRO . 15.8 tp -111.96 121.98 38.15 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -167.227 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' PRO . . . . . 0.706 ' HD2' HD12 ' A' ' 118' ' ' LEU . 14.5 Cg_exo -72.13 157.49 54.01 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.847 3.031 . . . . 0.0 113.372 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' VAL . . . . . 0.999 HG22 ' HE1' ' A' ' 39' ' ' TRP . 9.3 m -69.62 -14.41 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.385 -175.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' TYR . . . . . 0.586 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -56.46 -22.3 31.28 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -168.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 40.7 t -124.75 16.41 8.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.818 0.342 . . . . 0.0 110.919 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' LEU . . . . . 0.578 HD13 HG22 ' A' ' 106' ' ' THR . 72.7 mt -131.63 -54.34 1.01 Allowed 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.138 -0.351 . . . . 0.0 111.705 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' ALA . . . . . 0.528 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -129.98 111.74 17.17 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.828 0.346 . . . . 0.0 110.583 -175.131 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 125' ' ' PRO . . . . . 0.44 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 89.8 Cg_endo -87.54 -4.67 7.4 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.029 2.486 . . . . 0.0 117.787 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 126' ' ' PRO . . . . . 0.528 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 30.6 Cg_endo -63.89 -26.31 67.14 Favored 'Trans proline' 0 C--N 1.371 1.734 0 CA-C-N 123.076 2.134 . . . . 0.0 112.499 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' ILE . . . . . 0.786 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.396 0 CA-C-O 121.438 0.637 . . . . 0.0 110.107 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.3 mp -80.35 96.54 6.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.783 0.325 . . . . 0.0 111.476 -175.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.5 t30 53.06 71.54 0.48 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.792 177.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -124.89 105.35 9.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.188 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -118.47 35.79 4.64 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.9 p 48.15 57.55 6.01 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.987 -175.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -103.07 121.94 43.62 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.545 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.72 1.03 77.86 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.829 -0.701 . . . . 0.0 111.704 -175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.2 t -151.35 134.99 16.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.922 0.392 . . . . 0.0 110.215 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.42 96.53 0.82 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.387 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.9 t 71.93 124.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 123.329 0.652 . . . . 0.0 111.491 178.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.73 -68.24 0.76 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.378 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.819 ' H ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -69.42 -23.88 63.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.658 0.742 . . . . 0.0 110.269 -179.264 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.496 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 103.99 103.17 2.79 Favored Glycine 0 N--CA 1.441 -0.985 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -169.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.55 ' O ' ' HB ' ' A' ' 99' ' ' THR . 2.4 ppt_? -75.02 -8.58 56.94 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -173.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.403 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 3.5 p-10 -94.89 149.2 21.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 173.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.782 ' HG3' ' HA2' ' A' ' 103' ' ' GLY . 7.9 tt0 -83.62 119.09 73.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -165.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.535 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 5.8 Cg_exo -78.6 -164.53 0.28 Allowed 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.876 3.051 . . . . 0.0 112.125 171.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp -52.3 132.78 34.46 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 122.777 0.431 . . . . 0.0 111.183 178.363 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.727 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -80.76 87.81 5.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.273 0.559 . . . . 0.0 111.435 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.669 ' HD2' ' N ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -98.5 -25.06 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.106 175.913 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.669 ' N ' ' HD2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -50.73 151.32 2.45 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.389 -178.326 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.721 ' H ' ' HD2' ' A' ' 36' ' ' LYS . 1.2 mptt -96.05 159.95 31.06 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.681 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.605 ' HB2' HG12 ' A' ' 120' ' ' VAL . 13.8 Cg_exo -67.44 135.88 37.93 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.88 1.72 . . . . 0.0 111.063 174.079 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.65 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 32.5 ttpt -111.71 141.47 45.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.276 -0.42 . . . . 0.0 112.078 -168.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 1.071 ' HE1' HG22 ' A' ' 120' ' ' VAL . 3.1 p-90 147.51 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 O-C-N 125.281 1.613 . . . . 0.0 110.357 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.603 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.73 171.28 7.68 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.042 -176.847 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.467 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 15.0 m -64.61 133.28 51.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.776 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -71.43 -31.86 67.7 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -129.51 85.24 59.38 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.84 170.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.467 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 4.3 Cg_exo -75.86 134.23 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.417 2.078 . . . . 0.0 110.534 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.703 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 90.8 mtp -102.98 -81.99 0.5 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.963 0.411 . . . . 0.0 110.699 -178.513 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.844 HG21 HD22 ' A' ' 139' ' ' LEU . 75.4 p -115.37 -177.12 3.07 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.218 178.398 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -53.14 -49.64 66.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.263 0.352 . . . . 0.0 111.197 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.57 -48.03 84.16 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.127 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.703 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 75.3 mm-40 -61.82 -45.08 95.38 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.505 HD22 HG12 ' A' ' 130' ' ' ILE . 57.5 tp -58.98 -57.35 13.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.621 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.8 ptm180 -63.51 -45.05 92.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.6 m -64.79 -53.02 53.59 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 121.23 -0.188 . . . . 0.0 111.013 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.419 -0.513 . . . . 0.0 111.269 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.556 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 45.6 ttp180 -53.34 -53.52 49.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.658 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -66.26 -43.71 85.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.69 -177.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -51.7 -52.24 49.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.241 176.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -71.38 -36.86 71.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.69 0.281 . . . . 0.0 110.728 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.556 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -49.83 -41.61 45.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.587 176.539 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -58.22 -28.57 64.97 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.723 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.7 m -103.05 -0.22 31.07 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.458 -172.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.776 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -75.58 -75.58 0.1 OUTLIER Pre-proline 0 CA--C 1.544 0.737 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -173.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.776 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 77.7 Cg_endo -81.02 -23.82 5.12 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 121.389 1.392 . . . . 0.0 113.478 -167.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 56.2 -106.42 0.32 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.881 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.566 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -110.98 -23.04 11.19 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.512 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.566 ' HB2' ' O ' ' A' ' 64' ' ' PHE . 29.7 mt-10 76.03 -172.6 0.1 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.664 0.786 . . . . 0.0 109.8 -168.585 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.429 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . -146.51 -55.82 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 119.664 -1.255 . . . . 0.0 114.375 -172.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.715 ' HB3' HG22 ' A' ' 70' ' ' ILE . 13.1 tpt180 -155.76 106.95 2.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.729 0.299 . . . . 0.0 110.385 -169.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.518 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 75.7 mmtt -63.76 -28.36 69.83 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.351 0.596 . . . . 0.0 109.708 174.373 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HB2' ' HG3' ' A' ' 67' ' ' ARG . 18.1 mm-40 -59.63 -40.15 86.66 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.634 177.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.715 HG22 ' HB3' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -82.68 -23.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.991 -178.586 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.67 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -48.71 -38.42 21.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.799 -177.258 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -52.6 -40.98 63.25 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.196 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 -32.91 59.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.266 0.555 . . . . 0.0 110.294 -176.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.505 HD22 ' SG ' ' A' ' 108' ' ' CYS . 32.4 mt -68.4 -43.72 76.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.929 -175.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.3 ptpt -74.56 -30.45 61.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.451 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.36 -35.68 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.967 0.413 . . . . 0.0 110.483 175.744 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.0 -45.09 75.06 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.352 176.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.607 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -50.04 -39.33 41.54 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.57 0.544 . . . . 0.0 110.805 171.088 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.447 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 71.3 t60 -60.9 -51.0 71.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.473 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.31 -50.03 69.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.774 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -60.25 -37.23 79.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.433 -177.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -60.46 -32.04 71.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 110.724 174.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 11.3 m -89.36 16.94 6.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.44 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' SER . 52.3 m-80 77.5 3.55 3.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.831 0.852 . . . . 0.0 111.741 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.536 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 7.3 m-20 -80.24 84.68 5.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 110.324 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 93.0 m-70 -70.93 -43.24 68.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.972 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -63.75 -39.64 94.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.139 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.536 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 12.1 mt -60.11 -49.0 79.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.795 0.331 . . . . 0.0 110.823 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.649 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -64.54 -34.16 77.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.127 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -64.8 -44.64 89.27 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.723 0.297 . . . . 0.0 110.784 173.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ALA . . . . . 0.51 ' O ' ' HA3' ' A' ' 95' ' ' GLY . . . -67.63 -21.26 65.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.909 -177.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.5 mt -83.3 -61.62 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.433 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.649 HG12 ' O ' ' A' ' 89' ' ' ALA . 7.9 mm -56.46 -62.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.517 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.616 ' OD1' ' HB3' ' A' ' 30' ' ' GLN . 3.5 m-20 -72.53 -14.59 61.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.358 -178.671 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLY . . . . . 0.51 ' HA3' ' O ' ' A' ' 91' ' ' ALA . . . -74.13 -21.62 78.82 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.174 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -83.01 -55.62 4.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 110.647 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 65.0 t30 156.31 -30.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -176.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.968 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -54.24 137.05 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 112.936 -1.938 . . . . 0.0 110.947 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 11.2 p -144.57 174.14 11.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.324 0.583 . . . . 0.0 112.175 -175.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.766 HD11 ' O ' ' A' ' 107' ' ' GLU . 82.8 mt -145.73 137.31 12.94 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.463 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.496 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 73.8 Cg_endo -80.33 -6.94 13.91 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.312 1.341 . . . . 0.0 110.45 164.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -80.79 -59.65 2.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.893 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.782 ' HA2' ' HG3' ' A' ' 30' ' ' GLN . . . 95.19 40.74 4.19 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.083 -1.055 . . . . 0.0 111.912 -172.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.401 ' H ' HD13 ' A' ' 100' ' ' LEU . . . -115.77 153.4 31.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.323 0.582 . . . . 0.0 111.476 -177.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.607 HD11 ' HA ' ' A' ' 78' ' ' ALA . 2.0 tm? -91.25 -16.44 27.6 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.4 p -91.91 9.68 31.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.947 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.766 ' O ' HD11 ' A' ' 100' ' ' LEU . 27.6 mt-10 -145.59 151.96 38.93 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.505 ' SG ' HD22 ' A' ' 74' ' ' LEU . 94.4 m -155.86 138.73 15.3 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.385 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -115.73 123.06 47.33 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.717 0.77 . . . . 0.0 110.09 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.968 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.8 t70 -91.75 152.67 20.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.247 -1.342 . . . . 0.0 110.307 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.5 -23.43 65.91 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.244 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.426 ' HB2' ' ND2' ' A' ' 114' ' ' ASN . 21.4 mt -78.83 1.83 22.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.959 0.409 . . . . 0.0 111.014 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.67 26.81 12.4 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.957 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 90.2 m-20 -101.98 155.27 18.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.888 -173.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -138.52 137.46 37.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.084 0.469 . . . . 0.0 110.609 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 13.0 m-85 -117.76 132.45 56.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.437 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 6.2 mm-40 -123.86 121.36 35.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 -176.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 33.9 tp -103.75 120.59 50.94 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -169.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.583 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 21.2 Cg_exo -71.38 156.42 58.64 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 123.869 3.046 . . . . 0.0 112.79 175.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.071 HG22 ' HE1' ' A' ' 39' ' ' TRP . 21.1 m -67.72 -18.75 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.896 -172.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.583 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 3.9 p90 -61.01 -18.13 56.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.843 0.354 . . . . 0.0 111.546 -170.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.9 t -103.44 -0.56 29.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.436 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -137.08 -54.35 0.7 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -175.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.483 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -135.11 119.34 13.4 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.517 -170.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 68.7 Cg_endo -101.48 21.64 0.19 Allowed 'Trans proline' 0 CA--C 1.558 1.69 0 C-N-CA 122.945 2.43 . . . . 0.0 117.002 178.354 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.483 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 41.9 Cg_endo -70.04 -34.49 13.56 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-N 122.339 1.871 . . . . 0.0 111.897 175.471 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.82 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -81.61 51.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.56 0.695 . . . . 0.0 110.852 179.114 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -121.72 -42.03 2.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.24 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 3.0 tpt -94.59 -49.77 5.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.883 0.373 . . . . 0.0 110.411 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.505 HG12 HD22 ' A' ' 50' ' ' LEU . 17.0 mm 72.5 -73.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.595 176.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.441 ' HA ' HG13 ' A' ' 136' ' ' ILE . 3.3 pt-20 -76.23 71.16 2.93 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.919 -174.12 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -90.44 179.74 5.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.466 172.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.494 ' HE2' ' O ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -85.43 29.7 0.66 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.289 0.566 . . . . 0.0 110.853 -178.652 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 4.0 p -80.49 -17.28 52.11 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.33 171.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -162.95 -48.3 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.986 176.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.441 HG13 ' HA ' ' A' ' 131' ' ' GLU . 19.0 mm -66.68 138.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.511 . . . . 0.0 111.632 -175.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -139.5 -55.88 0.58 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.591 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 37.8 m -151.33 102.28 2.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.622 -177.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.844 HD22 HG21 ' A' ' 46' ' ' THR . 27.4 tp -87.44 78.35 8.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.209 0.528 . . . . 0.0 109.625 174.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -100.7 -27.99 13.08 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.998 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 3.7 pt . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.868 178.377 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.477 0.895 0 CA-C-O 120.798 0.332 . . . . 0.0 110.521 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 15' ' ' LEU . 3.4 mm? -126.17 122.6 36.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.892 0.377 . . . . 0.0 110.971 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -91.15 91.3 8.18 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.468 ' HA ' ' OE1' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -63.81 153.57 36.2 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.688 0.756 . . . . 0.0 112.107 -174.725 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -96.05 27.31 3.68 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.727 -177.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.8 m -79.9 46.44 0.79 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.188 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.517 ' HG2' HG23 ' A' ' 22' ' ' THR . 40.1 tt0 70.66 -60.07 0.51 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.504 0.722 . . . . 0.0 111.59 177.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.425 ' HA2' ' O ' ' A' ' 24' ' ' VAL . . . 86.66 39.02 7.83 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.126 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.517 HG23 ' HG2' ' A' ' 20' ' ' GLU . 28.0 p -102.03 54.29 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.448 0.642 . . . . 0.0 109.999 175.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.96 23.13 23.7 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -171.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.425 ' O ' ' HA2' ' A' ' 21' ' ' GLY . 96.4 t -140.19 110.32 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -175.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.71 -79.45 0.24 Allowed 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.866 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mp -75.78 -60.86 2.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 122.069 0.937 . . . . 0.0 109.469 175.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.609 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 160.62 100.31 0.16 Allowed Glycine 0 N--CA 1.44 -1.093 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.886 -178.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.684 ' O ' ' HB ' ' A' ' 99' ' ' THR . 0.0 OUTLIER -56.62 -32.74 65.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.924 0.392 . . . . 0.0 111.385 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.601 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 30.8 p-10 -108.91 158.7 17.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 170.062 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 34.1 tt0 -80.27 111.32 21.38 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -162.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.671 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 4.8 Cg_exo -79.71 -164.57 0.29 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.743 2.962 . . . . 0.0 109.972 166.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 28.4 tp -52.74 132.06 35.82 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 176.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.537 ' HE3' ' CZ ' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -57.25 109.53 0.68 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.361 0.6 . . . . 0.0 111.319 -175.656 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.877 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 10.8 mmpt? -97.55 -19.86 18.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.053 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.19 170.07 8.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.493 0.664 . . . . 0.0 111.605 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -109.38 159.85 29.87 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.04 -177.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.732 ' HB2' HG12 ' A' ' 120' ' ' VAL . 33.1 Cg_exo -51.29 128.73 26.39 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.567 2.178 . . . . 0.0 112.294 -175.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.486 ' HE2' ' HB3' ' A' ' 38' ' ' LYS . 24.3 ttpt -113.46 123.21 49.5 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.253 -170.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 1.02 ' HE1' HG22 ' A' ' 120' ' ' VAL . 3.1 p-90 -176.3 25.17 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.666 -1.152 . . . . 0.0 109.441 172.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HE2' HG21 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -157.59 166.02 34.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.979 -167.309 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 52.1 m -69.37 128.75 37.66 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 165.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -76.92 -18.31 58.37 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TYR . . . . . 0.519 ' CE2' ' HG2' ' A' ' 45' ' ' MET . 51.2 t80 -133.34 75.0 71.05 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.215 170.153 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.757 ' HG2' HG12 ' A' ' 130' ' ' ILE . 50.4 Cg_exo -62.45 -26.36 76.47 Favored 'Trans proline' 0 CA--C 1.508 -0.809 0 C-N-CA 123.853 3.035 . . . . 0.0 113.549 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.519 ' HG2' ' CE2' ' A' ' 43' ' ' TYR . 54.1 mtt 78.18 -82.64 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.696 -1.593 . . . . 0.0 110.797 -177.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.626 ' HA ' ' HG2' ' A' ' 131' ' ' GLU . 67.3 p -115.69 175.85 5.34 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.102 -177.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.604 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 0.8 OUTLIER -68.12 -36.7 80.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.432 0.158 . . . . 0.0 110.618 -177.966 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.08 -41.94 94.83 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.167 -0.54 . . . . 0.0 111.863 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.513 ' HB2' ' O ' ' A' ' 44' ' ' PRO . 17.8 mm-40 -74.46 -38.49 62.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.597 HD22 HD13 ' A' ' 130' ' ' ILE . 59.8 tp -54.48 -54.34 42.28 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.299 0.375 . . . . 0.0 111.15 178.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 14.9 ptm180 -64.51 -47.1 80.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.323 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.1 t -60.64 -45.35 94.38 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.684 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.482 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 65.5 mmtt -72.72 -30.09 63.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.495 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -57.94 -41.32 82.54 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.55 -50.64 35.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.438 0.637 . . . . 0.0 110.745 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -54.91 -46.85 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.633 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.482 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 34.0 m-85 -70.48 -36.43 73.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.467 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -30.58 48.0 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.388 0.43 . . . . 0.0 111.223 176.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -60.62 -34.25 73.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 112.074 173.69 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 m -100.0 -27.1 13.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.977 -171.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.506 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -52.1 -52.93 57.48 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -175.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.506 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 49.4 Cg_endo -84.48 -7.18 9.85 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.166 1.911 . . . . 0.0 112.877 -177.16 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 61.86 -116.31 0.6 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.398 -176.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.489 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 22.7 m-85 -109.37 -47.08 3.45 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.225 0.536 . . . . 0.0 110.684 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 64' ' ' PHE . 55.2 mm-40 -163.23 177.63 8.87 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.21 -178.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.492 ' HA2' ' OD1' ' A' ' 114' ' ' ASN . . . -133.34 141.84 13.27 Favored Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.347 173.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.664 ' O ' HG22 ' A' ' 70' ' ' ILE . 33.7 mmt180 -66.51 94.72 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 171.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' A' ' 68' ' ' LYS . 15.1 tptm -50.85 -37.11 41.29 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.793 -171.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -58.41 -33.43 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.664 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -82.77 -22.52 8.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.229 -178.618 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.626 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -50.62 -37.2 38.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.808 -173.285 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -59.24 -34.24 71.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.326 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.22 -29.01 42.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.02 0.438 . . . . 0.0 110.091 -178.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.605 HD21 HD13 ' A' ' 70' ' ' ILE . 34.2 mt -67.96 -49.27 62.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.467 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.4 ptpt -69.01 -28.99 67.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.708 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.74 -38.72 76.92 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.179 176.609 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.402 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -67.95 -51.35 48.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.618 178.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -51.54 -34.13 35.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 172.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 28.5 t60 -64.18 -47.55 79.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.133 0.492 . . . . 0.0 109.81 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.46 ' HB1' ' HB2' ' A' ' 88' ' ' LEU . . . -68.85 -53.46 21.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.537 ' CZ ' ' HE3' ' A' ' 33' ' ' LYS . 12.7 t80 -54.44 -28.5 44.55 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.802 177.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -63.17 -28.82 70.32 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.591 -0.693 . . . . 0.0 111.229 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.7 t -92.15 15.26 13.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.469 0.652 . . . . 0.0 109.455 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 57.4 t30 70.71 7.44 6.22 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.012 -178.279 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.435 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 4.7 m-20 -73.84 82.05 1.64 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.199 0.524 . . . . 0.0 110.441 176.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 -72.09 -37.25 69.61 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.458 174.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 88' ' ' LEU . 10.2 pt-20 -53.67 -43.7 69.07 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.699 178.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.482 ' O ' HG13 ' A' ' 92' ' ' ILE . 14.5 mt -65.65 -51.93 55.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.981 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.573 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -63.27 -40.11 96.47 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.92 -176.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -66.17 -38.78 88.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.772 0.32 . . . . 0.0 110.195 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.55 -21.0 61.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.666 -179.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.3 mt -81.84 -60.68 2.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.861 177.051 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.573 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -52.66 -61.81 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.416 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.26 -25.25 65.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.564 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -75.24 -12.61 83.41 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.951 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -102.07 6.63 41.09 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.987 -0.126 . . . . 0.0 110.881 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.8 t30 74.14 8.11 4.69 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.982 0.896 . . . . 0.0 109.525 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.934 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -90.51 138.2 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.348 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.684 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 19.8 p -123.19 164.79 18.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.362 -177.038 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.851 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.6 tm? -150.42 104.11 3.11 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.483 178.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.713 ' HD2' HD22 ' A' ' 100' ' ' LEU . 67.4 Cg_endo -71.62 -7.9 22.12 Favored 'Trans proline' 0 N--CA 1.476 0.475 0 C-N-CA 123.325 2.684 . . . . 0.0 114.216 -173.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.635 ' H ' HD13 ' A' ' 100' ' ' LEU . 29.7 m-70 -82.72 -15.45 51.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 177.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.671 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 68.77 37.67 84.51 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.275 -176.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.851 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -135.36 152.76 51.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 121.267 0.556 . . . . 0.0 111.572 -175.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.476 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.6 tm? -79.55 -21.92 44.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.279 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 118' ' ' LEU . 37.7 p -87.7 24.09 1.81 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.242 -173.827 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.686 ' HB3' HD21 ' A' ' 100' ' ' LEU . 32.5 mt-10 -156.07 149.56 24.76 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.44 ' SG ' HD22 ' A' ' 74' ' ' LEU . 74.8 m -151.31 139.44 20.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.04 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.484 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 12.5 m-30 -118.72 121.59 40.46 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.89 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.934 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.0 OUTLIER -84.5 145.12 28.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.106 178.915 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -58.6 -31.81 68.4 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 124.649 1.218 . . . . 0.0 111.835 -171.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 16.8 mt -69.36 -40.5 77.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.568 -177.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 141.75 43.6 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.766 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.875 ' HB3' ' HB3' ' A' ' 110' ' ' ASP . 1.8 t-20 -109.14 152.49 25.04 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.287 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.484 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 38.6 ttp180 -134.73 128.03 32.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.785 0.326 . . . . 0.0 110.31 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -117.37 137.97 52.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.808 177.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -122.29 119.45 31.18 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.502 ' HB2' ' O ' ' A' ' 106' ' ' THR . 4.0 mm? -95.53 115.34 65.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -170.384 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.561 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 33.7 Cg_exo -69.21 155.2 68.46 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 124.169 3.246 . . . . 0.0 113.622 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.02 HG22 ' HE1' ' A' ' 39' ' ' TRP . 11.1 m -72.69 -23.02 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 114.75 -1.114 . . . . 0.0 112.631 -171.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.561 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.6 p90 -55.95 -29.69 60.55 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -168.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.6 t -99.32 -1.71 38.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.598 0.237 . . . . 0.0 111.34 -175.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.3 mt -133.85 -71.38 0.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.975 -174.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.701 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -118.76 116.06 34.83 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.606 -170.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 83.0 Cg_endo -104.16 32.61 0.06 OUTLIER 'Trans proline' 0 CA--C 1.556 1.582 0 C-N-CA 123.045 2.497 . . . . 0.0 116.539 177.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.73 -19.61 18.37 Favored 'Trans proline' 0 C--N 1.367 1.506 0 CA-C-N 121.945 1.73 . . . . 0.0 111.68 172.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.666 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -90.91 52.74 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.471 0.653 . . . . 0.0 109.921 176.495 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -112.27 -56.63 2.37 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.297 -177.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 41.4 ttp -104.35 89.66 3.31 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.757 HG12 ' HG2' ' A' ' 44' ' ' PRO . 3.4 mp -75.59 -52.09 19.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.246 -178.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.626 ' HG2' ' HA ' ' A' ' 46' ' ' THR . 7.5 mt-10 -62.56 100.62 0.2 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.437 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.77 -106.0 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.032 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -76.23 -69.46 0.5 Allowed 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 173.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.3 t 38.24 -108.88 0.07 Allowed 'General case' 0 CA--C 1.535 0.374 0 O-C-N 123.955 0.785 . . . . 0.0 111.984 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -115.94 -8.24 11.91 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.196 0.522 . . . . 0.0 111.236 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 46.7 mm -55.62 139.87 14.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.942 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 44.76 42.0 5.55 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.22 -175.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 24.6 m -133.65 126.76 31.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.783 0.325 . . . . 0.0 110.626 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.8 tp -142.3 44.4 1.65 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.843 0.83 . . . . 0.0 110.322 177.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -122.59 10.97 9.79 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.111 -0.95 . . . . 0.0 108.725 175.178 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 2.6 pt . . . . . 0 C--O 1.247 0.954 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.12 -174.318 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -98.88 39.55 1.26 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.214 0.53 . . . . 0.0 110.158 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -122.94 33.17 5.48 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.303 0.573 . . . . 0.0 110.197 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -87.93 52.77 2.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.991 -174.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -82.73 15.41 2.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.914 -173.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.4 m -116.7 7.37 13.48 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.316 0.579 . . . . 0.0 109.77 175.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.562 ' HA ' ' H ' ' A' ' 24' ' ' VAL . 26.6 tt0 -78.35 12.9 1.72 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.249 -173.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -59.07 -33.75 75.99 Favored Glycine 0 C--N 1.331 0.271 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 173.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.8 t -111.22 23.12 14.44 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.328 0.585 . . . . 0.0 109.674 175.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.0 50.66 63.32 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.765 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.859 HG22 ' HG3' ' A' ' 28' ' ' ARG . 25.4 t -143.07 118.65 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-O 121.143 0.497 . . . . 0.0 109.791 -177.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.37 -70.11 0.39 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.795 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.638 HD13 ' H ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -115.54 -18.21 10.99 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.613 -0.435 . . . . 0.0 111.887 -178.678 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.766 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 141.78 87.02 0.1 Allowed Glycine 0 C--O 1.222 -0.627 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.771 176.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.859 ' HG3' HG22 ' A' ' 24' ' ' VAL . 8.8 mtt180 -62.24 -30.69 71.28 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.564 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 8.7 p30 -109.67 161.51 15.32 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -176.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.606 ' HA ' ' HA2' ' A' ' 103' ' ' GLY . 26.2 tt0 -79.67 109.27 11.25 Favored Pre-proline 0 CA--C 1.534 0.331 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -165.281 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.939 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 73.2 Cg_endo -76.63 -165.29 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.335 2.69 . . . . 0.0 111.425 171.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.649 HD23 ' HE3' ' A' ' 34' ' ' LYS . 17.9 tp -48.33 138.06 10.38 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.189 0.518 . . . . 0.0 111.119 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.831 ' HG2' ' HB2' ' A' ' 105' ' ' LEU . 0.4 OUTLIER -76.9 94.15 3.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.874 -172.136 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.649 ' HE3' HD23 ' A' ' 32' ' ' LEU . 32.8 mmtp -98.68 -42.28 7.31 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.479 ' HG2' ' HZ3' ' A' ' 38' ' ' LYS . 9.4 tp10 -68.66 156.45 38.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.638 0.732 . . . . 0.0 112.543 -169.896 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.491 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 35.7 mmtm -95.08 160.93 29.82 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.251 -179.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.774 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 20.6 Cg_exo -66.44 138.37 50.2 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.239 1.959 . . . . 0.0 112.41 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.704 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 3.7 mtmt -110.76 148.98 31.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.847 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 1.029 ' HE1' HG22 ' A' ' 120' ' ' VAL . 0.8 OUTLIER 125.64 -4.52 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.105 0 O-C-N 126.047 2.092 . . . . 0.0 108.945 -171.186 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.543 ' HD2' ' O ' ' A' ' 41' ' ' SER . 0.0 OUTLIER -115.94 151.9 34.5 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.563 -167.466 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.543 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 58.4 m -64.98 149.08 50.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.456 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -56.81 -50.57 71.98 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -139.22 102.6 7.38 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.548 171.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.524 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 15.0 Cg_exo -67.88 131.63 24.53 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.077 1.851 . . . . 0.0 109.828 172.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.76 -81.3 0.33 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.742 -175.417 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.604 ' HB ' HG21 ' A' ' 136' ' ' ILE . 43.1 p -115.17 -175.52 2.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.894 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.502 ' HB2' ' OE2' ' A' ' 131' ' ' GLU . 9.0 t70 -68.13 -36.53 79.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.788 0.328 . . . . 0.0 111.133 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.543 ' O ' ' HG2' ' A' ' 51' ' ' ARG . . . -63.07 -42.14 99.64 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.881 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -68.16 -37.7 81.3 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 1.4 tt -59.47 -55.33 35.97 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.029 178.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.543 ' HG2' ' O ' ' A' ' 48' ' ' GLY . 5.9 ptp180 -58.7 -46.99 86.07 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.754 0.311 . . . . 0.0 111.756 -176.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.47 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 74.2 m -67.35 -52.06 44.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.171 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -66.64 -32.67 74.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.242 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 54' ' ' ARG . 11.0 ttm180 -55.41 -48.29 74.6 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.22 -47.99 77.56 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.654 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 52' ' ' SER . 59.8 mt-10 -52.64 -48.47 66.39 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.762 177.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -66.1 -40.33 90.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.574 178.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.449 ' HA ' ' HB3' ' A' ' 61' ' ' ALA . 7.1 m95 -54.1 -31.36 51.81 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 177.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -66.96 -19.07 65.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.855 0.359 . . . . 0.0 111.27 176.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.8 m -108.27 -16.46 14.24 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.603 0.716 . . . . 0.0 110.224 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.844 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -76.88 169.61 20.34 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.303 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.844 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 36.0 Cg_endo -60.1 -50.78 6.71 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.546 2.164 . . . . 0.0 113.069 -176.259 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 55.42 -107.44 0.38 Allowed 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.833 -177.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -108.7 -12.13 14.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -175.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -74.82 152.18 38.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.214 0.53 . . . . 0.0 111.899 -171.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 115.0 -127.89 7.87 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.722 176.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.614 ' HB2' HG22 ' A' ' 70' ' ' ILE . 5.3 mmp_? -143.36 126.62 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 122.72 0.408 . . . . 0.0 109.992 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -71.02 -26.82 63.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.084 0.469 . . . . 0.0 110.072 176.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.402 ' OE2' ' HD3' ' A' ' 67' ' ' ARG . 2.3 mp0 -60.53 -43.1 97.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.945 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.844 HD12 ' HB2' ' A' ' 110' ' ' ASP . 0.0 OUTLIER -80.8 -23.42 10.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.189 -176.637 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.558 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 2.0 m95 -52.5 -37.11 56.62 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -177.33 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -58.11 -35.36 71.33 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.278 0.361 . . . . 0.0 111.08 -177.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.25 -29.85 57.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.108 0.48 . . . . 0.0 110.555 -178.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.504 HD21 ' CD1' ' A' ' 70' ' ' ILE . 16.8 mt -67.72 -53.4 27.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.185 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.7 ptpt -65.13 -30.42 71.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.898 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.84 -36.97 76.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.103 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.08 -50.38 48.86 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.601 0.239 . . . . 0.0 110.438 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -31.92 61.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.419 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 24.5 t60 -63.78 -47.37 81.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 109.846 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -70.99 -52.37 20.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.827 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.568 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 21.0 t80 -57.28 -35.14 69.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.486 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.06 -27.13 68.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.943 0.401 . . . . 0.0 111.322 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -94.97 22.11 6.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.28 177.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 70.9 m-20 77.02 0.96 3.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.648 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.777 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 2.0 m-20 -77.46 84.37 3.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.321 0.581 . . . . 0.0 110.705 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 33' ' ' LYS . 98.8 m-70 -71.92 -39.68 69.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.947 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -69.82 -37.71 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.385 -177.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.777 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -62.99 -51.22 67.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.931 0.396 . . . . 0.0 110.768 -179.846 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.806 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -62.34 -46.43 88.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.576 -175.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 20.5 pt20 -63.79 -34.46 77.96 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.59 0.233 . . . . 0.0 110.528 179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.17 -26.61 62.15 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.918 0.39 . . . . 0.0 110.557 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.8 mt -72.01 -47.06 56.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 174.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.649 HG23 HG22 ' A' ' 98' ' ' ILE . 9.7 mm -49.8 -61.83 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.529 173.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.166 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.56 -23.9 70.71 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.44 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 98' ' ' ILE . . . -99.97 9.27 43.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.154 -178.023 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 62.6 t30 69.85 11.93 7.85 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.83 1.3 . . . . 0.0 108.882 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.649 HG22 HG23 ' A' ' 93' ' ' ILE . 51.2 mt -83.88 141.0 15.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 113.343 -1.753 . . . . 0.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.641 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 30.0 p -134.5 168.6 18.66 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.101 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.536 HD21 ' C ' ' A' ' 107' ' ' GLU . 4.0 mt -150.2 106.5 3.17 Favored Pre-proline 0 N--CA 1.449 -0.506 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.05 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.766 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 24.9 Cg_endo -63.14 -26.36 72.89 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 121.431 1.421 . . . . 0.0 110.574 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -77.23 -20.89 54.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.798 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.939 ' HA3' ' HD2' ' A' ' 31' ' ' PRO . . . 55.96 38.26 74.27 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 114.819 -1.082 . . . . 0.0 114.18 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.434 ' O ' HD13 ' A' ' 100' ' ' LEU . . . -110.93 149.21 30.97 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.756 0.313 . . . . 0.0 110.978 -177.019 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.831 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.84 -24.41 44.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.909 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.774 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 47.4 p -85.21 26.82 0.85 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.583 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.536 ' C ' HD21 ' A' ' 100' ' ' LEU . 20.1 mt-10 -165.48 156.98 14.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.261 175.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.507 ' HA ' HD21 ' A' ' 100' ' ' LEU . 86.9 m -156.22 139.86 15.99 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 172.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.525 ' CD2' ' HD2' ' A' ' 101' ' ' PRO . 18.3 m-30 -116.87 121.98 43.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.972 0.891 . . . . 0.0 110.266 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.879 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 3.5 t70 -80.48 149.07 30.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.249 -177.518 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -59.66 -25.97 65.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.933 -1.03 . . . . 0.0 112.714 -168.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -74.8 -9.6 58.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.208 0.528 . . . . 0.0 110.642 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.16 26.04 6.17 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.95 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.879 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 64.5 m-80 -94.73 150.24 20.41 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.425 ' HA ' ' HD1' ' A' ' 109' ' ' TYR . 10.3 ptp180 -123.37 144.69 49.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.045 0.45 . . . . 0.0 109.881 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -136.01 142.45 44.47 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.155 174.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.506 ' HA ' ' HG2' ' A' ' 107' ' ' GLU . 45.7 mt-30 -122.31 119.9 32.49 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.403 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 0.2 OUTLIER -85.67 112.5 45.13 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.45 -171.658 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.556 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 37.0 Cg_exo -69.16 154.71 69.68 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.586 2.857 . . . . 0.0 113.404 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.029 HG22 ' HE1' ' A' ' 39' ' ' TRP . 32.6 m -61.52 -16.82 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.94 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.556 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.7 p90 -59.24 -21.02 58.91 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -169.07 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 20.6 t -126.88 14.44 7.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.013 0.435 . . . . 0.0 110.688 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.706 HD13 HG22 ' A' ' 106' ' ' THR . 65.7 mt -132.54 -53.04 0.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.949 0.404 . . . . 0.0 111.902 -176.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.582 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -128.05 114.88 20.33 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-O 120.712 0.291 . . . . 0.0 110.953 -173.395 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.434 ' N ' ' CD ' ' A' ' 126' ' ' PRO . 75.6 Cg_endo -96.99 16.21 0.7 Allowed 'Trans proline' 0 CA--C 1.558 1.719 0 C-N-CA 123.012 2.475 . . . . 0.0 117.162 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.582 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 39.9 Cg_endo -68.66 -16.32 42.13 Favored 'Trans proline' 0 C--N 1.371 1.742 0 CA-C-N 122.486 1.924 . . . . 0.0 111.656 173.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.633 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -110.62 46.69 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.202 177.467 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -91.51 -36.75 13.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.875 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' MET . . . . . 0.435 ' HG3' ' O ' ' A' ' 131' ' ' GLU . 39.6 tpp -115.89 -43.32 3.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 5.2 mp 69.17 -70.95 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 123.254 0.622 . . . . 0.0 111.697 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.502 ' OE2' ' HB2' ' A' ' 47' ' ' ASP . 9.2 pt-20 -74.75 154.2 38.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.292 -178.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -87.91 164.97 15.58 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt 20.38 -89.03 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 O-C-N 125.356 1.66 . . . . 0.0 113.902 -174.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 20.9 t 179.36 81.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 -176.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -134.05 -41.02 0.83 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.989 -178.525 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.687 HG22 ' HG3' ' A' ' 137' ' ' GLU . 47.6 mm -36.06 -80.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 124.438 1.086 . . . . 0.0 113.607 -174.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.687 ' HG3' HG22 ' A' ' 136' ' ' ILE . 84.3 mt-10 -117.26 37.09 3.98 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.041 0.448 . . . . 0.0 110.67 177.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 19.3 m -82.69 78.07 9.36 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.018 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 22.0 tp -93.14 139.49 30.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.036 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -98.27 -28.55 13.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.83 0.348 . . . . 0.0 110.927 -175.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 141' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 141' ' ' ILE . 28.7 pt . . . . . 0 C--O 1.247 0.962 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.418 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.895 0.379 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -79.33 83.91 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.091 0.472 . . . . 0.0 111.005 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -154.28 134.57 13.31 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 177.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -80.59 -19.34 45.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.828 0.347 . . . . 0.0 110.381 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -84.48 152.39 23.99 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.9 p -79.11 46.18 0.69 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.46 ' CG ' ' HB2' ' A' ' 25' ' ' ALA . 24.6 mm-40 64.98 116.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.205 0.602 . . . . 0.0 112.175 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.28 -15.1 81.35 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.2 p -62.51 -24.86 67.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.346 -0.427 . . . . 0.0 110.942 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 131.32 71.89 0.1 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.625 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.0 t 73.52 125.26 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-O 121.597 0.713 . . . . 0.0 112.321 174.563 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.46 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . . . -103.73 -88.13 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.334 175.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.471 HD21 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.91 -16.0 60.1 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.002 -178.139 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.568 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 112.03 98.45 2.41 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.562 177.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.687 HH11 ' HB3' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -67.38 -27.15 66.86 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 121.426 0.631 . . . . 0.0 110.401 175.087 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.687 ' HB3' HH11 ' A' ' 28' ' ' ARG . 4.9 p-10 -97.28 160.33 14.39 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.753 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -81.37 106.29 5.57 Favored Pre-proline 0 C--N 1.326 -0.431 0 O-C-N 123.589 0.555 . . . . 0.0 112.36 -169.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.704 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 91.4 Cg_endo -79.59 -164.99 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 123.284 2.656 . . . . 0.0 111.222 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.2 mp -50.58 137.65 19.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.785 0.326 . . . . 0.0 110.757 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.721 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -75.43 100.62 4.53 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.375 1.083 . . . . 0.0 111.201 -171.007 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -98.4 -19.14 17.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.228 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.774 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 4.0 tp10 -95.67 149.26 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.091 0.472 . . . . 0.0 110.751 -174.168 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -98.73 161.47 24.91 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.617 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.662 ' HG3' HG21 ' A' ' 106' ' ' THR . 32.0 Cg_exo -55.58 142.23 81.98 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.617 2.211 . . . . 0.0 112.995 -177.286 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.644 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 36.2 ttpt -111.54 135.69 51.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.384 -170.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 1.043 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.4 p-90 152.01 -17.25 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.792 1.307 . . . . 0.0 110.961 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.474 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.41 164.51 13.51 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.573 0.225 . . . . 0.0 110.881 -174.664 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 39.7 m -65.27 119.73 11.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.839 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -67.5 -28.76 68.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -126.18 89.77 51.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.369 167.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.596 ' HB2' HG13 ' A' ' 130' ' ' ILE . 3.4 Cg_exo -79.16 137.12 13.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.973 2.449 . . . . 0.0 112.262 177.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.42 ' HB3' ' H ' ' A' ' 46' ' ' THR . 12.4 mmm -108.03 -137.64 0.37 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 174.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.42 ' H ' ' HB3' ' A' ' 45' ' ' MET . 47.5 p -81.03 -175.19 5.28 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.783 -177.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.488 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 21.0 t70 -56.69 -49.58 74.69 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -168.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.07 -36.14 91.85 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.706 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -72.37 -44.17 62.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 0.0 110.263 175.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.458 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 50.6 tp -60.3 -45.52 93.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.807 -178.411 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 12.4 ptp180 -64.68 -50.84 65.42 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.463 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 26.7 t -64.07 -57.38 9.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.693 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 57' ' ' PHE . 2.0 tppt? -63.99 -28.05 69.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.138 -174.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 40.5 ttm180 -58.1 -45.65 86.86 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 172.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.2 -49.32 61.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 2.0 mp0 -50.36 -47.36 56.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.541 0.686 . . . . 0.0 110.495 174.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -69.4 -38.81 78.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.832 -179.246 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.483 ' CE3' ' HB3' ' A' ' 61' ' ' ALA . 2.3 m95 -53.2 -29.48 32.24 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.435 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 9.4 t70 -58.15 -27.16 63.54 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.492 0.663 . . . . 0.0 110.767 172.499 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.9 m -105.59 13.16 30.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.542 0.687 . . . . 0.0 110.096 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 1.003 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -99.33 175.81 2.26 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 1.003 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 31.6 Cg_endo -60.29 -6.02 4.78 Favored 'Trans proline' 0 C--N 1.365 1.419 0 C-N-CA 124.657 3.571 . . . . 0.0 116.001 -170.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -39.18 -46.73 1.52 Allowed 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -173.309 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -81.49 -9.13 59.77 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -173.659 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 42.27 -136.47 0.29 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.249 1.02 . . . . 0.0 112.358 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -179.88 -102.05 0.16 Allowed Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.555 -0.618 . . . . 0.0 111.555 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.682 ' O ' HG22 ' A' ' 70' ' ' ILE . 4.0 mmp_? -108.74 96.13 6.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 110.54 -0.17 . . . . 0.0 110.54 177.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.545 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 16.7 tptm -45.74 -35.09 4.03 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.222 0.609 . . . . 0.0 111.726 178.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.447 ' H ' ' HG3' ' A' ' 69' ' ' GLU . 20.5 mt-10 -50.57 -40.25 51.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.12 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.682 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.9 OUTLIER -82.83 -22.1 9.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -175.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.545 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.09 -40.18 14.7 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 122.866 0.467 . . . . 0.0 111.881 -171.932 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.91 -36.84 70.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.581 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.61 -26.04 45.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.159 0.504 . . . . 0.0 110.296 -176.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.587 HD21 HD13 ' A' ' 70' ' ' ILE . 51.4 mt -70.29 -46.31 64.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.611 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 0.4 OUTLIER -72.71 -25.85 61.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.716 177.179 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -68.26 -39.67 82.14 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.726 0.298 . . . . 0.0 110.702 174.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -65.8 -47.35 75.4 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.483 176.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.674 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -49.96 -39.65 41.33 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.597 171.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 22.3 t60 -62.33 -47.69 83.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.224 -178.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -65.12 -53.95 37.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 177.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.599 ' HE1' ' HE3' ' A' ' 33' ' ' LYS . 9.6 t80 -53.94 -30.51 46.84 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.423 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.674 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.0 mt-10 -56.64 -40.66 75.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 175.063 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -84.96 20.34 1.88 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.463 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.7 t30 71.59 9.65 6.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.217 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.629 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 2.5 t0 -80.79 83.77 6.47 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.489 0.661 . . . . 0.0 110.536 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -72.56 -41.55 65.61 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.094 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.08 -43.8 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.286 -176.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.483 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.0 mt -55.58 -52.79 62.57 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 120.802 0.334 . . . . 0.0 110.771 175.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.632 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -61.74 -47.3 85.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.792 -176.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -27.67 65.71 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.61 -177.781 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -74.76 -32.56 62.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.846 0.355 . . . . 0.0 110.254 176.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.3 mt -68.76 -57.2 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.349 176.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -51.03 -61.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.208 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.41 ' HA ' ' O ' ' A' ' 98' ' ' ILE . 21.1 t70 -71.33 -18.25 62.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.252 -174.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.96 -11.52 70.02 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.121 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -108.93 8.68 26.52 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.097 -0.061 . . . . 0.0 111.029 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.1 m-80 72.95 4.34 4.94 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.313 0.578 . . . . 0.0 110.392 -173.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 1.101 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -83.73 134.88 25.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.736 172.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 21.3 p -138.97 166.36 24.69 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.772 -177.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.87 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.4 tm? -148.12 104.34 3.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.743 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.568 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 32.1 Cg_endo -63.81 -30.54 68.5 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.195 2.597 . . . . 0.0 113.779 -173.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -68.29 -9.55 48.45 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.67 0.272 . . . . 0.0 111.671 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.721 ' O ' ' HA ' ' A' ' 33' ' ' LYS . . . 73.49 18.29 79.34 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.328 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.87 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -95.01 140.31 30.15 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.511 0.672 . . . . 0.0 111.373 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.652 HD11 ' HA ' ' A' ' 78' ' ' ALA . 2.5 tm? -83.15 -16.34 47.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.184 175.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.662 HG21 ' HG3' ' A' ' 37' ' ' PRO . 59.8 p -91.07 14.99 12.51 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.05 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 28.9 mt-10 -149.84 144.71 26.14 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 78.9 m -150.86 138.33 19.56 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 175.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.434 ' CD1' ' HG2' ' A' ' 115' ' ' ARG . 16.3 m-30 -116.93 122.5 44.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.511 0.672 . . . . 0.0 109.533 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 1.101 ' HA ' HG13 ' A' ' 98' ' ' ILE . 2.6 t70 -81.38 148.29 29.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.021 -173.43 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -55.26 -27.74 48.56 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 124.551 1.157 . . . . 0.0 112.645 -171.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.4 mt -78.95 -7.37 57.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.944 0.402 . . . . 0.0 110.874 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 23.44 7.27 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.182 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.994 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 59.1 m-80 -92.58 161.63 14.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.779 0.323 . . . . 0.0 110.904 -176.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.434 ' HG2' ' CD1' ' A' ' 109' ' ' TYR . 78.0 mtt180 -129.82 128.13 41.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.07 0.462 . . . . 0.0 111.187 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' TYR . . . . . 0.589 ' HE1' ' H ' ' A' ' 67' ' ' ARG . 20.2 m-85 -117.98 124.06 47.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.715 171.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -123.88 121.14 34.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.048 -171.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.59 HD23 HG22 ' A' ' 106' ' ' THR . 38.0 tp -98.99 119.82 59.96 Favored Pre-proline 0 C--N 1.319 -0.757 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -170.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.627 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 24.5 Cg_exo -69.38 156.2 65.03 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.313 2.675 . . . . 0.0 112.739 174.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.043 HG22 ' HE1' ' A' ' 39' ' ' TRP . 33.7 m -66.81 -15.79 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.273 -175.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.627 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.3 p90 -58.67 -21.65 54.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.944 0.402 . . . . 0.0 111.865 -172.327 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 37.0 t -101.61 2.4 38.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.179 -175.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 61.9 mt -139.6 -52.05 0.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.821 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.455 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -137.37 114.37 9.67 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.991 -173.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 88.5 Cg_endo -103.3 27.19 0.1 OUTLIER 'Trans proline' 0 CA--C 1.555 1.556 0 C-N-CA 122.973 2.448 . . . . 0.0 117.043 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.524 ' HD2' HD13 ' A' ' 127' ' ' ILE . 80.7 Cg_endo -81.35 -19.04 8.09 Favored 'Trans proline' 0 C--N 1.365 1.428 0 CA-C-N 122.268 1.846 . . . . 0.0 112.205 173.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.773 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -100.38 46.07 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.257 0.551 . . . . 0.0 110.442 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -101.8 -52.77 3.11 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.256 -176.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 50.9 tpp -131.7 131.46 43.09 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 173.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.916 HG22 ' HG2' ' A' ' 131' ' ' GLU . 36.3 mm -99.79 -109.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.815 -172.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.916 ' HG2' HG22 ' A' ' 130' ' ' ILE . 2.3 pt-20 -110.49 125.55 53.43 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-O 121.662 0.744 . . . . 0.0 112.485 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.781 ' HB2' ' HB3' ' A' ' 135' ' ' ASP . 34.7 mm-40 -71.73 -178.99 2.44 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.505 -1.225 . . . . 0.0 112.103 -178.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.58 ' HD2' ' N ' ' A' ' 134' ' ' SER . 0.0 OUTLIER -54.78 -47.5 73.87 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.11 -176.928 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.58 ' N ' ' HD2' ' A' ' 133' ' ' LYS . 33.0 m -156.91 36.74 0.3 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.219 0.533 . . . . 0.0 109.689 -178.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.781 ' HB3' ' HB2' ' A' ' 132' ' ' GLU . 24.8 t70 -98.85 -46.37 5.67 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.801 HG13 ' HA ' ' A' ' 131' ' ' GLU . 10.6 mm -85.17 139.11 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.259 177.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -147.85 -80.25 0.14 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.78 177.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.6 m -156.32 75.12 0.86 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.33 0.586 . . . . 0.0 109.744 176.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 22.5 tp -157.09 145.01 19.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.785 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -99.16 -19.96 16.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.169 0.509 . . . . 0.0 110.725 -175.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 3.9 pt . . . . . 0 C--O 1.25 1.117 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.942 179.311 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.478 0.954 0 N-CA-C 110.663 -0.125 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.4 mt 55.36 -91.86 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.77 0.669 . . . . 0.0 111.555 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -120.43 106.16 11.57 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -160.33 26.34 0.16 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.218 0.532 . . . . 0.0 110.771 -172.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -75.71 -67.73 0.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.017 0.437 . . . . 0.0 110.167 178.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.613 ' OG ' ' HD3' ' A' ' 28' ' ' ARG . 12.2 p -165.09 -86.0 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 57.75 80.2 0.18 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 168.231 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.5 -9.44 67.71 Favored Glycine 0 N--CA 1.453 -0.187 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.277 175.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.6 p -97.62 9.68 41.87 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.719 0.771 . . . . 0.0 109.978 -178.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 116.09 -179.88 17.96 Favored Glycine 0 N--CA 1.443 -0.861 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.126 -176.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.517 HG13 ' H ' ' A' ' 28' ' ' ARG . 88.7 t -126.68 99.59 5.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.974 0.416 . . . . 0.0 110.214 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -89.71 -80.94 0.3 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.418 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -16.14 63.26 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.656 0.265 . . . . 0.0 111.267 -177.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.7 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 110.32 108.98 3.15 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.926 176.579 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.751 ' O ' ' HB ' ' A' ' 99' ' ' THR . 22.1 mmm180 -68.8 -60.76 2.16 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 121.081 0.467 . . . . 0.0 110.996 172.061 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.415 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 28.0 p-10 -90.11 156.38 18.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.337 -174.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.692 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 9.0 pt20 -90.46 117.26 67.87 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -169.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.615 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.0 Cg_exo -70.18 -163.59 0.12 Allowed 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.959 3.106 . . . . 0.0 112.172 170.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.25 139.01 15.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.857 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.925 ' HZ2' ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -107.47 104.98 14.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.713 -170.057 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.579 ' HD3' ' O ' ' A' ' 34' ' ' LYS . 11.8 tmtt? -99.14 -24.12 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.51 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.611 ' OE1' ' HB3' ' A' ' 102' ' ' HIS . 44.3 mt-10 -71.39 167.4 19.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.524 0.678 . . . . 0.0 112.226 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' N ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -105.86 152.9 40.34 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.328 -166.22 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.76 ' HG3' HG21 ' A' ' 106' ' ' THR . 24.8 Cg_exo -62.01 144.88 96.74 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.021 2.481 . . . . 0.0 111.913 177.003 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.508 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 18.3 ttpp -112.22 115.88 29.53 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -168.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 1.008 ' HE1' HG12 ' A' ' 120' ' ' VAL . 1.1 p-90 170.71 20.84 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 113.2 -1.818 . . . . 0.0 109.966 173.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.567 ' HD2' ' O ' ' A' ' 41' ' ' SER . 1.6 tmmt? -128.34 147.97 50.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.04 0.448 . . . . 0.0 110.733 -159.563 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.567 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 58.2 m -64.62 140.31 58.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.571 -175.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.97 -39.36 74.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.678 175.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -140.99 92.22 8.68 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.053 171.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.553 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 7.4 Cg_exo -72.42 134.58 22.85 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.477 2.118 . . . . 0.0 110.502 175.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.1 ttp -112.66 -86.12 0.57 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.254 -175.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.579 ' HA ' ' CG ' ' A' ' 131' ' ' GLU . 46.4 p -117.67 -173.81 2.5 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.468 ' OD2' ' HD2' ' A' ' 51' ' ' ARG . 16.5 t70 -49.44 -44.87 45.87 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.866 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -53.19 -42.79 63.22 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.286 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 14.0 mm100 -72.23 -41.96 66.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.722 0.296 . . . . 0.0 110.333 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.75 -57.37 13.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.159 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.468 ' HD2' ' OD2' ' A' ' 47' ' ' ASP . 12.0 ptm180 -63.64 -45.52 89.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.494 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 31.1 t -65.41 -53.79 37.97 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.846 -176.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -65.77 -35.22 80.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.963 -179.363 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.44 ' HG3' ' CZ3' ' A' ' 39' ' ' TRP . 59.5 ttp180 -56.07 -46.5 78.96 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.435 0.159 . . . . 0.0 110.928 178.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.11 -52.7 46.22 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 120.998 0.428 . . . . 0.0 110.678 -177.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -55.76 -49.7 72.4 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.17 -45.27 81.51 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.564 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.423 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -50.14 -36.62 30.73 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.286 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -54.94 -41.02 70.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.724 0.297 . . . . 0.0 111.542 175.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -113.08 10.59 18.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.187 0.518 . . . . 0.0 111.376 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.751 ' O ' ' HB2' ' A' ' 117' ' ' GLN . . . -66.55 -60.18 6.97 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-O 119.085 -0.484 . . . . 0.0 111.047 -177.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.728 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 95.9 Cg_endo -87.05 -9.73 6.11 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 121.876 1.717 . . . . 0.0 111.712 176.362 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 63.46 -103.32 0.11 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.626 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -109.52 -8.62 14.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.934 -177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 56.42 -112.23 0.68 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -166.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.91 -99.72 0.24 Allowed Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 119.513 -1.327 . . . . 0.0 113.824 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.616 ' HD3' ' OD2' ' A' ' 110' ' ' ASP . 7.8 ttt180 -99.5 113.81 26.41 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 122.894 0.478 . . . . 0.0 109.758 -173.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.456 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 72.9 mmtt -75.64 -26.65 57.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -58.09 -37.16 73.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.168 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.682 HD12 HG12 ' A' ' 98' ' ' ILE . 0.8 OUTLIER -82.97 -22.01 8.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.553 -179.41 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.56 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -47.28 -41.73 19.44 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -172.83 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.566 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 11.9 m-20 -56.44 -31.29 63.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.08 -33.13 50.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.024 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.523 HD21 HD13 ' A' ' 70' ' ' ILE . 26.3 mt -70.55 -45.45 65.42 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.527 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 14.1 ptpt -68.9 -33.08 73.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.776 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -67.32 -36.05 80.67 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.954 0.407 . . . . 0.0 110.659 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.501 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -69.92 -48.99 56.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.708 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -52.6 -33.96 48.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.503 173.151 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.413 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 29.5 t60 -65.95 -51.36 59.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.509 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.14 -46.7 82.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.676 177.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -59.43 -33.61 71.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.241 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.46 -38.44 84.21 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.304 0.573 . . . . 0.0 110.823 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 22.7 t -85.72 21.31 1.9 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.322 -177.316 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 83' ' ' SER . 16.5 m120 73.82 0.43 3.63 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.838 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.653 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 14.8 m-20 -79.07 83.31 5.16 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.687 0.756 . . . . 0.0 110.314 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 58.6 m80 -71.9 -40.59 68.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.28 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.616 ' HA ' ' HG2' ' A' ' 90' ' ' GLN . 5.3 pt-20 -74.46 -31.52 62.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.26 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.653 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 10.1 mt -58.87 -51.55 69.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.174 0.511 . . . . 0.0 110.204 173.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.551 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -62.41 -44.23 96.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.001 -175.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.616 ' HG2' ' HA ' ' A' ' 87' ' ' GLU . 3.4 pt20 -66.88 -33.31 75.32 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.729 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.23 -26.24 61.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.855 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 88' ' ' LEU . 51.1 mt -74.15 -55.12 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 177.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.8 mm -52.18 -59.18 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.551 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.86 -27.26 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.709 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.78 -20.52 66.43 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.531 -0.758 . . . . 0.0 113.098 -177.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.542 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -84.48 -53.22 5.58 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.136 0.468 . . . . 0.0 110.21 179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.542 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.4 t-20 152.29 -28.29 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -175.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 1.015 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -57.66 145.38 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 112.44 -2.163 . . . . 0.0 111.734 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.751 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 33.7 p -132.74 165.47 24.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.568 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.845 HD22 ' HD2' ' A' ' 101' ' ' PRO . 2.3 tm? -150.84 113.51 3.16 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 173.053 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.845 ' HD2' HD22 ' A' ' 100' ' ' LEU . 13.2 Cg_endo -55.68 -42.14 70.47 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 124.012 3.141 . . . . 0.0 114.759 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.611 ' HB3' ' OE1' ' A' ' 35' ' ' GLU . 5.4 m-70 -72.66 -21.25 61.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -176.562 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.615 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 86.15 17.12 61.55 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.933 -173.499 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.677 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -93.6 143.56 26.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.064 0.459 . . . . 0.0 110.971 -175.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.705 ' HB2' ' HG3' ' A' ' 33' ' ' LYS . 3.0 tm? -78.49 -32.03 48.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.779 -178.113 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.76 HG21 ' HG3' ' A' ' 37' ' ' PRO . 53.3 p -84.47 16.83 2.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.549 -172.458 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.603 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 41.1 mt-10 -148.5 140.95 24.28 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.091 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 76.8 m -152.19 145.14 24.45 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -118.67 122.8 43.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 1.015 ' HA ' HG13 ' A' ' 98' ' ' ILE . 12.6 t70 -80.92 148.41 29.87 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.236 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -57.5 -24.31 55.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.797 -1.092 . . . . 0.0 112.331 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.419 HD12 ' HD2' ' A' ' 67' ' ' ARG . 27.7 mt -79.23 -5.07 53.5 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.928 0.394 . . . . 0.0 110.949 -178.625 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.43 29.85 6.49 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.154 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.772 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 17.1 m120 -101.52 158.23 16.23 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.91 -0.171 . . . . 0.0 110.764 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -129.45 129.71 44.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.368 0.604 . . . . 0.0 110.762 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' TYR . . . . . 0.516 ' HE1' ' H ' ' A' ' 67' ' ' ARG . 17.3 m-85 -117.71 128.44 54.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.869 177.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.751 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 3.8 mm100 -123.21 127.23 48.33 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.511 HD23 HG22 ' A' ' 106' ' ' THR . 36.1 tp -98.75 124.24 46.73 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.385 -171.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.652 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 12.3 Cg_exo -72.82 155.04 53.93 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.33 2.687 . . . . 0.0 112.777 177.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.008 HG12 ' HE1' ' A' ' 39' ' ' TRP . 0.3 OUTLIER -76.45 -20.38 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 114.901 -1.045 . . . . 0.0 112.515 -171.244 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.652 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -57.08 -30.09 64.03 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.147 -171.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 46.9 t -94.51 -6.53 43.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.302 -173.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.495 HD12 ' HG3' ' A' ' 37' ' ' PRO . 94.6 mt -118.63 -54.12 2.28 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -175.492 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.432 ' HB3' HG22 ' A' ' 120' ' ' VAL . . . -117.67 111.75 39.33 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.154 0.502 . . . . 0.0 111.929 -172.357 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.37 -39.53 45.94 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 123.745 2.964 . . . . 0.0 115.862 176.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -42.69 -59.12 1.04 Allowed 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.658 2.239 . . . . 0.0 114.507 -175.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.844 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -85.59 18.05 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.894 0.378 . . . . 0.0 111.746 -176.609 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -107.39 -18.38 13.88 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 172.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 44.5 ttm -102.77 -54.04 2.73 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.935 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.632 ' HB ' ' OE2' ' A' ' 131' ' ' GLU . 18.3 mt 66.75 -79.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 O-C-N 124.059 0.849 . . . . 0.0 112.178 176.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.752 ' HB2' HG13 ' A' ' 136' ' ' ILE . 2.3 mp0 -61.13 138.25 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.561 0.538 . . . . 0.0 110.315 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -87.63 -169.55 2.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.031 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -77.5 74.42 4.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.561 0.696 . . . . 0.0 111.253 -172.216 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.5 p -108.04 -75.83 0.62 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.0 169.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -98.52 -30.11 12.7 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.223 173.033 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.752 HG13 ' HB2' ' A' ' 131' ' ' GLU . 29.2 mm -62.12 158.53 3.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.644 -177.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.403 ' N ' HG22 ' A' ' 136' ' ' ILE . 29.0 mt-10 -117.52 123.18 45.66 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -176.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.0 m -68.39 100.08 1.03 Allowed 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.475 175.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 9.6 mp -79.41 167.85 20.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.91 0.386 . . . . 0.0 110.955 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -122.78 21.22 10.03 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 8.0 pt . . . . . 0 C--O 1.25 1.091 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.552 177.218 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.5 m . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 120.606 0.241 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 64.74 36.21 8.26 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.966 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -149.7 135.92 18.96 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.918 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 63.59 59.17 1.22 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.264 0.554 . . . . 0.0 110.41 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -76.93 132.5 39.1 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.744 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 t 61.33 -87.42 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.046 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -84.6 -17.57 38.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.781 0.324 . . . . 0.0 111.231 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.54 -47.32 3.81 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.427 178.59 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.0 t -66.36 -18.65 65.48 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.04 0.448 . . . . 0.0 110.826 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.84 -147.15 4.48 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 176.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 4.9 p -92.38 -31.62 4.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 174.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 24' ' ' VAL . . . 167.55 -94.16 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.5 1.12 . . . . 0.0 107.982 172.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.461 HD21 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -126.57 -3.99 6.61 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.142 175.021 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.66 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 120.19 45.52 0.4 Allowed Glycine 0 N--CA 1.443 -0.855 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.559 -175.508 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.593 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.0 ppt_? -64.32 -32.34 73.9 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.238 -173.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.715 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -93.39 156.73 16.61 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 171.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.425 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.9 OUTLIER -81.12 104.21 2.64 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -158.927 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.935 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 92.5 Cg_endo -78.87 -162.46 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 123.733 2.955 . . . . 0.0 111.839 172.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.561 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.1 mp -49.01 144.68 4.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.308 0.575 . . . . 0.0 112.044 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.547 ' HD2' ' N ' ' A' ' 33' ' ' LYS . 8.6 mptt -84.85 83.29 8.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.313 -178.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -97.68 -18.33 18.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.936 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.924 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 9.2 tp10 -87.16 159.73 18.77 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.223 0.535 . . . . 0.0 110.451 -177.711 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.48 ' HG2' ' OE2' ' A' ' 35' ' ' GLU . 16.6 pttm -99.99 155.13 36.79 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.109 -173.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.635 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 5.1 Cg_exo -73.97 143.28 32.57 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.302 2.001 . . . . 0.0 111.514 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.737 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 23.5 ttpp -110.88 145.69 37.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.225 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 1.103 ' HE1' HG22 ' A' ' 120' ' ' VAL . 0.9 OUTLIER 134.43 -3.68 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 O-C-N 125.227 1.579 . . . . 0.0 109.844 -172.937 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -113.48 158.73 20.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -167.199 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.448 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 25.0 m -65.23 125.26 24.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.524 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -61.91 -26.35 68.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.407 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -146.0 88.95 6.19 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.395 173.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.448 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 6.4 Cg_exo -75.4 137.34 20.72 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.924 2.416 . . . . 0.0 111.273 176.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 64.1 mtm -114.66 -75.39 0.59 Allowed 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -177.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.815 ' HA ' ' HG2' ' A' ' 131' ' ' GLU . 78.3 p -115.54 175.68 5.41 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.474 -0.491 . . . . 0.0 111.323 -178.694 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.01 -41.89 97.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.015 0.436 . . . . 0.0 110.077 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.81 -44.3 87.07 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.697 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -68.67 -45.07 72.69 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -54.92 -47.47 74.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.797 -177.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.0 ptm180 -73.42 -39.44 65.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.604 0.24 . . . . 0.0 111.477 -176.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 m -68.82 -42.18 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 60.1 mmtt -71.58 -32.57 68.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.055 177.196 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -53.2 -48.46 68.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.088 0.471 . . . . 0.0 110.041 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.35 -52.58 64.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.99 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.79 -49.34 75.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.722 -1.127 . . . . 0.0 111.734 -177.048 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.404 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 42.6 m-85 -70.36 -37.16 74.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.744 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.18 -37.56 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 177.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -66.74 -20.29 65.93 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.826 0.346 . . . . 0.0 111.784 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 15.4 m -95.08 -11.87 27.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 109.659 178.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.465 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -86.0 158.23 56.12 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.424 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.465 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 19.3 Cg_endo -85.2 -10.57 7.85 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.016 2.478 . . . . 0.0 113.749 -170.454 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 54.61 -111.12 0.6 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.446 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -108.57 -1.49 19.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.888 0.375 . . . . 0.0 110.893 -176.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -76.31 151.71 36.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.833 -172.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.433 ' HA2' ' CE1' ' A' ' 116' ' ' TYR . . . 136.47 179.01 16.24 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.922 -178.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.679 ' O ' HG22 ' A' ' 70' ' ' ILE . 2.7 mmp_? -63.66 80.89 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 171.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.495 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 13.5 tptm -49.62 -37.82 29.5 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.897 0.479 . . . . 0.0 112.119 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.41 -40.74 62.51 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.186 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.679 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -84.32 -23.81 7.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.9 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.639 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -53.0 -38.49 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.259 -173.316 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.583 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 18.4 m-20 -62.49 -28.67 69.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.25 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.95 -27.58 39.75 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.519 0.676 . . . . 0.0 109.551 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.662 HD13 ' SG ' ' A' ' 108' ' ' CYS . 27.7 mt -74.71 -43.55 54.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.527 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.1 ptpt -70.53 -29.83 66.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.61 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.97 -38.29 72.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.767 175.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.64 -44.24 87.03 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.514 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -48.45 -41.14 28.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.694 170.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 29.7 t60 -62.26 -48.94 77.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.329 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -62.5 -53.03 60.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.622 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.522 ' HD2' HD22 ' A' ' 123' ' ' LEU . 20.6 t80 -55.47 -39.34 70.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.526 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.513 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.3 mt-10 -61.1 -33.75 73.87 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 8.1 t -87.57 20.11 3.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.159 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 83' ' ' SER . 3.4 m-20 73.44 4.8 4.89 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.751 0.82 . . . . 0.0 111.599 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.857 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 54.0 m-20 -82.35 84.1 7.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.825 0.821 . . . . 0.0 110.966 -179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.561 ' NE2' ' HA ' ' A' ' 32' ' ' LEU . 8.0 t-80 -69.03 -42.3 76.56 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.113 177.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.33 -33.75 71.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.146 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.857 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 7.0 mp -65.32 -56.32 13.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.975 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.616 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.67 -41.11 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.508 -176.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -69.35 -30.35 68.36 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.018 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.63 -21.99 51.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.938 0.399 . . . . 0.0 110.762 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 52.9 mt -77.93 -56.84 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.538 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 89' ' ' ALA . 10.1 mm -50.52 -60.67 0.79 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.122 176.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.02 -24.96 66.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.1 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.38 -16.74 73.78 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.859 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -97.99 5.59 48.64 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 122.718 -0.284 . . . . 0.0 110.893 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.6 t30 78.14 0.65 2.71 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.724 0.773 . . . . 0.0 109.76 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.943 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -89.71 144.92 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.426 177.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.593 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 22.7 p -140.62 171.1 14.58 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.456 -177.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.754 HD12 ' H ' ' A' ' 104' ' ' ALA . 1.6 tm? -148.59 103.36 3.46 Favored Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.13 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.66 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 21.2 Cg_endo -60.7 -25.13 80.38 Favored 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.763 2.975 . . . . 0.0 114.094 -174.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.556 ' H ' HD13 ' A' ' 100' ' ' LEU . 90.8 m-70 -76.26 -13.08 60.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.889 0.375 . . . . 0.0 110.402 177.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.935 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 77.32 9.18 86.97 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.652 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.924 ' HB2' ' HB3' ' A' ' 35' ' ' GLU . . . -94.47 142.82 26.99 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.65 0.738 . . . . 0.0 111.612 -174.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.537 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.5 tm? -78.64 -14.23 59.42 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.225 -1.352 . . . . 0.0 107.792 173.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.635 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 25.4 p -84.24 6.85 21.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.153 -175.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -145.06 161.1 40.27 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.692 ' SG ' ' HB2' ' A' ' 116' ' ' TYR . 3.9 p -155.53 133.03 11.06 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.79 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.503 ' HA ' ' O ' ' A' ' 114' ' ' ASN . 19.4 m-30 -118.75 121.32 39.81 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.568 0.699 . . . . 0.0 109.573 177.148 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.943 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -87.29 152.27 22.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.773 -174.334 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.07 -25.47 63.79 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.854 -1.067 . . . . 0.0 112.645 -169.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.9 mt -79.05 -11.53 60.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.553 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.72 31.19 3.75 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.057 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.902 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 43.7 m-80 -96.11 145.09 25.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.689 0.281 . . . . 0.0 111.179 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.477 ' HA ' ' HD1' ' A' ' 109' ' ' TYR . 18.6 ptt180 -123.94 128.4 49.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.647 175.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' TYR . . . . . 0.692 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 35.3 m-85 -128.25 148.04 50.62 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 176.214 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 62' ' ' PRO . 9.3 mm100 -121.3 120.89 36.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.425 -173.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.723 HD12 ' HD2' ' A' ' 119' ' ' PRO . 13.9 tp -96.57 117.07 66.33 Favored Pre-proline 0 C--N 1.316 -0.868 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.584 -172.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.764 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 35.1 Cg_exo -62.51 154.99 60.87 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.821 3.014 . . . . 0.0 113.744 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.103 HG22 ' HE1' ' A' ' 39' ' ' TRP . 3.7 m -68.84 -16.49 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.223 -174.655 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.764 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.1 p90 -61.26 -18.28 57.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -169.879 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.5 t -121.06 14.54 11.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.059 -176.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.605 ' CD1' HG22 ' A' ' 106' ' ' THR . 95.8 mt -140.77 -52.22 0.47 Allowed 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.898 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.527 ' HB3' ' HB ' ' A' ' 120' ' ' VAL . . . -109.85 156.45 39.85 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.621 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.566 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 74.1 Cg_exo -53.3 -168.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.269 0 C-N-CA 123.618 2.879 . . . . 0.0 112.158 170.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.566 ' HD2' ' HB3' ' A' ' 125' ' ' PRO . 82.8 Cg_endo -69.74 13.51 0.28 Allowed 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.041 1.827 . . . . 0.0 112.654 -178.329 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.438 ' H ' ' C ' ' A' ' 125' ' ' PRO . 42.5 mm 68.4 -42.8 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.486 ' O ' HG13 ' A' ' 130' ' ' ILE . 49.9 t30 -153.01 149.01 27.73 Favored 'General case' 0 N--CA 1.419 -2.007 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 -177.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' MET . . . . . 0.726 ' SD ' ' HA ' ' A' ' 134' ' ' SER . 52.3 ttm -64.62 -17.26 63.84 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 121.51 0.672 . . . . 0.0 109.557 175.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 128' ' ' ASN . 45.4 mt 71.91 -86.07 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.741 170.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.815 ' HG2' ' HA ' ' A' ' 46' ' ' THR . 29.1 mt-10 -79.78 143.98 33.97 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 121.044 0.45 . . . . 0.0 110.696 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -67.13 -178.99 0.88 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.82 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.558 ' HE3' ' HB2' ' A' ' 135' ' ' ASP . 21.5 ttpp 71.26 -1.39 2.75 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.572 175.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.726 ' HA ' ' SD ' ' A' ' 129' ' ' MET . 19.7 m 59.29 41.72 19.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.518 -178.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' ASP . . . . . 0.558 ' HB2' ' HE3' ' A' ' 133' ' ' LYS . 15.1 t70 -86.7 -37.57 17.82 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -176.317 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 15.6 mm -82.21 136.06 23.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.446 173.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 50.04 70.28 0.52 Allowed 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.704 0.627 . . . . 0.0 109.922 -173.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 5.6 m -75.31 76.51 2.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.15 -174.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 20.9 tp -98.22 119.27 36.58 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.542 175.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -90.86 -36.03 14.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.565 0.698 . . . . 0.0 109.74 -177.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 2.7 pt . . . . . 0 C--O 1.248 0.975 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.966 179.852 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.5 p . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 120.619 0.247 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' A' ' 15' ' ' LEU . 1.6 tm? -99.26 94.48 6.49 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.496 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 3.5 t-20 -143.73 130.66 20.48 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.604 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 17.9 mm-40 75.81 129.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 124.422 1.076 . . . . 0.0 111.825 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -117.28 -177.34 3.2 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.196 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.2 t -146.98 47.12 1.16 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.393 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -77.86 162.06 27.14 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.283 -178.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.26 -46.23 3.17 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.738 -177.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.1 t -101.89 11.38 38.7 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.296 0.57 . . . . 0.0 109.807 175.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.2 -173.67 39.06 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.846 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.438 HG13 ' HG3' ' A' ' 28' ' ' ARG . 32.9 m -78.31 -31.25 16.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.519 0.676 . . . . 0.0 111.11 -177.458 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 179.56 -39.59 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 -174.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.684 HD13 ' H ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -121.02 -165.17 1.19 Allowed 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 114.032 -1.44 . . . . 0.0 107.457 165.6 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.789 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . -100.69 78.81 0.43 Allowed Glycine 0 C--N 1.309 -0.935 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.131 -173.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.701 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.9 mmt85 -33.96 -62.87 0.29 Allowed 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 123.511 0.724 . . . . 0.0 112.778 174.305 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.617 ' HB2' ' OD2' ' A' ' 94' ' ' ASP . 3.3 p-10 -89.87 156.84 18.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.498 -175.092 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -84.52 109.76 22.22 Favored Pre-proline 0 C--N 1.325 -0.5 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -166.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.776 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 88.1 Cg_endo -79.1 -164.92 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.702 2.935 . . . . 0.0 111.467 169.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.04 149.24 19.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.385 0.612 . . . . 0.0 112.114 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.635 ' HE2' ' N ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -75.69 102.52 5.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.047 -172.436 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -97.29 -20.87 17.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.475 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.676 ' HB2' ' HB2' ' A' ' 104' ' ' ALA . 47.1 mt-10 -103.28 171.86 7.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.03 0.919 . . . . 0.0 113.266 -172.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.608 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 26.7 pttt -106.84 160.29 26.83 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 113.27 -1.786 . . . . 0.0 109.409 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.856 ' HG2' HG12 ' A' ' 120' ' ' VAL . 10.6 Cg_endo -61.58 139.29 80.63 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.266 1.977 . . . . 0.0 112.557 172.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.654 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 2.7 mtmt -112.14 147.81 35.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.198 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.99 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.9 p-90 132.27 -16.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.616 1.967 . . . . 0.0 108.289 -175.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.642 ' HG2' HG13 ' A' ' 127' ' ' ILE . 10.1 tppt? -113.45 153.69 28.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.365 -174.12 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 48.9 m -65.49 135.02 54.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.265 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -72.08 -27.34 62.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.69 175.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -131.78 81.99 61.67 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.108 170.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.43 130.11 16.83 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.603 2.202 . . . . 0.0 111.053 177.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.538 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.0 mtp -102.1 -87.64 0.4 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -174.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.572 ' HA ' ' HG2' ' A' ' 131' ' ' GLU . 69.1 p -118.78 179.09 4.24 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.365 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.517 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.7 t70 -54.66 -48.04 72.82 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.16 -35.15 82.98 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.232 -0.508 . . . . 0.0 112.608 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.695 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 31.3 mm-40 -70.13 -51.55 30.61 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 175.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.439 HD21 ' HZ2' ' A' ' 40' ' ' LYS . 3.2 tm? -55.94 -47.97 76.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.808 -177.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.649 ' HG3' ' N ' ' A' ' 52' ' ' SER . 13.6 ptp180 -62.9 -48.94 76.78 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.235 0.334 . . . . 0.0 111.586 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.649 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 24.3 t -68.46 -47.2 67.75 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -176.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.695 ' HB2' ' O ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -55.11 -44.45 74.99 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.512 173.897 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 62.0 ttt180 -60.77 -53.04 62.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.305 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.05 -49.93 74.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.77 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -51.97 -49.49 63.13 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.364 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.619 ' CD1' ' HA ' ' A' ' 39' ' ' TRP . 3.6 t80 -75.25 -38.91 60.3 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.581 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.504 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -53.99 -33.47 57.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.755 0.312 . . . . 0.0 111.338 -179.727 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.48 -25.85 68.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 0.0 111.566 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -109.13 -30.45 8.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.807 -172.048 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.654 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -49.49 -56.92 13.7 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -174.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 43.5 Cg_endo -89.26 -9.8 4.18 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.19 1.927 . . . . 0.0 113.042 -177.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.9 38.0 0.73 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -170.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -106.06 -8.76 17.34 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 66.24 150.84 0.05 Allowed 'General case' 0 N--CA 1.463 0.206 0 O-C-N 124.266 0.979 . . . . 0.0 112.094 -177.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.722 ' HA2' ' HB3' ' A' ' 114' ' ' ASN . . . -168.96 -123.53 0.68 Allowed Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.47 -177.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.552 ' H ' ' HE2' ' A' ' 116' ' ' TYR . 7.3 ttt85 -159.85 133.41 7.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.85 0.357 . . . . 0.0 110.185 -175.079 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 71' ' ' TRP . 75.4 mmtt -77.66 -25.64 49.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.12 -175.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -57.9 -52.91 63.56 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.315 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.678 HD12 HG12 ' A' ' 98' ' ' ILE . 0.1 OUTLIER -68.37 -23.13 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.71 -178.499 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.546 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 1.8 m95 -50.99 -34.33 28.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 111.481 -178.324 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.751 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 17.2 t70 -56.89 -39.87 75.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.829 177.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.74 -27.08 60.99 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.227 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.512 HD11 ' SG ' ' A' ' 108' ' ' CYS . 24.6 mt -68.92 -43.65 74.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.751 ' HE2' ' HA ' ' A' ' 72' ' ' ASP . 8.4 mtmt -64.95 -46.3 82.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -57.74 -43.93 85.71 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.669 178.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.522 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -68.01 -52.31 37.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.725 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.488 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -50.0 -35.28 24.0 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 123.451 0.469 . . . . 0.0 110.462 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.508 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 21.4 t60 -60.68 -52.24 65.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.28 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -67.68 -52.53 36.84 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.705 177.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -51.31 -36.12 41.12 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.782 178.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -57.49 -39.22 75.99 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.183 0.516 . . . . 0.0 111.138 175.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.5 t -87.63 23.72 1.89 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.214 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 71.89 5.2 5.28 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.072 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.542 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 8.8 t0 -79.58 89.63 5.1 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.491 0.662 . . . . 0.0 110.418 -178.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 95.7 m-70 -70.74 -35.82 72.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.008 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.577 ' HA ' HE21 ' A' ' 90' ' ' GLN . 9.4 pt-20 -70.22 -44.39 68.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.833 -170.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.448 ' O ' HG13 ' A' ' 92' ' ' ILE . 13.3 mt -60.65 -54.42 45.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.819 0.342 . . . . 0.0 111.316 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.499 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.71 -42.87 94.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.908 -174.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.577 HE21 ' HA ' ' A' ' 87' ' ' GLU . 25.8 pt20 -70.57 -32.89 70.46 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.68 -24.21 49.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 88' ' ' LEU . 41.2 mt -72.26 -57.7 6.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.391 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.504 ' CG2' HG22 ' A' ' 98' ' ' ILE . 9.6 mm -50.0 -57.49 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.839 174.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . 0.617 ' OD2' ' HB2' ' A' ' 29' ' ' ASN . 3.9 t70 -64.4 -31.53 72.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.852 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -74.36 -10.21 81.88 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.391 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.5 -0.68 51.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.681 -0.305 . . . . 0.0 110.415 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.8 t30 74.73 7.86 4.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 122.024 0.916 . . . . 0.0 109.071 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.97 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -87.38 137.09 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 114.455 -1.248 . . . . 0.0 108.74 172.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.701 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 40.1 p -120.37 166.09 14.01 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.218 -175.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.727 HD12 ' H ' ' A' ' 104' ' ' ALA . 1.6 tm? -149.47 101.44 3.3 Favored Pre-proline 0 N--CA 1.446 -0.658 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.666 176.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.789 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 26.4 Cg_endo -61.39 -16.79 49.43 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.801 3.001 . . . . 0.0 113.871 -172.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.669 ' H ' HD13 ' A' ' 100' ' ' LEU . 56.3 m-70 -82.83 -18.69 39.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.06 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.776 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 80.01 9.98 86.08 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.98 -0.628 . . . . 0.0 112.386 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.727 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -98.84 148.2 24.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.259 0.552 . . . . 0.0 111.776 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.6 tm? -79.15 -17.67 54.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 174.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.85 HG22 HD13 ' A' ' 123' ' ' LEU . 52.4 p -87.57 21.18 2.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.019 -171.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.486 ' HB3' HD21 ' A' ' 100' ' ' LEU . 49.1 mt-10 -157.12 160.37 38.77 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.681 ' SG ' ' HB2' ' A' ' 116' ' ' TYR . 13.3 p -154.8 139.37 16.92 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.318 174.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.452 ' HD1' ' O ' ' A' ' 108' ' ' CYS . 11.8 m-30 -118.52 120.86 38.78 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.698 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.988 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 5.0 t70 -80.69 145.23 31.7 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.674 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -60.01 -22.28 62.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.868 -170.384 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.18 28.65 4.31 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.311 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.988 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 60.7 m-80 -98.97 158.65 15.51 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.984 -0.127 . . . . 0.0 110.796 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -139.34 139.65 37.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.331 . . . . 0.0 111.467 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' TYR . . . . . 0.681 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 27.6 m-85 -136.67 152.75 50.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.113 175.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.448 ' O ' ' HD3' ' A' ' 119' ' ' PRO . 10.2 mm100 -122.05 120.83 35.49 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.002 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.633 ' HB2' ' C ' ' A' ' 106' ' ' THR . 4.1 mm? -90.06 109.79 35.55 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-O 121.143 0.497 . . . . 0.0 111.512 -176.151 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.537 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 22.1 Cg_exo -74.74 156.09 44.18 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 124.152 3.235 . . . . 0.0 113.633 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.99 HG22 ' HE1' ' A' ' 39' ' ' TRP . 4.9 m -63.63 -16.68 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.735 -1.12 . . . . 0.0 113.178 -173.096 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.537 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.2 p90 -58.35 -23.54 57.14 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -169.618 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 39.4 t -129.84 27.35 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.096 0.474 . . . . 0.0 109.877 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.85 HD13 HG22 ' A' ' 106' ' ' THR . 95.1 mt -138.27 -50.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.917 -176.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -135.08 111.5 11.03 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 120.962 0.41 . . . . 0.0 111.833 -175.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.655 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 31.6 Cg_exo -61.51 -43.57 26.8 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.545 2.83 . . . . 0.0 115.271 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.655 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 16.3 Cg_exo -29.68 -56.87 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 124.866 3.711 . . . . 0.0 115.63 -174.142 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.941 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -78.38 50.1 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.111 0.481 . . . . 0.0 111.853 -176.041 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -94.89 -61.38 1.5 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.561 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -81.93 -37.12 27.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -175.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 2.9 mp 66.78 -70.91 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 C-N-CA 123.093 0.557 . . . . 0.0 110.704 -174.159 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.768 ' HB2' HG13 ' A' ' 136' ' ' ILE . 28.2 mt-10 -74.85 165.7 24.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.932 0.396 . . . . 0.0 110.032 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -124.38 -151.6 0.48 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -169.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.409 ' HE3' ' HB2' ' A' ' 133' ' ' LYS . 16.4 ptmt 57.7 12.13 1.52 Allowed 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.347 1.459 . . . . 0.0 113.779 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.3 m 54.11 39.52 30.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.542 175.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -110.57 -36.41 5.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.257 0.551 . . . . 0.0 110.988 -177.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.768 HG13 ' HB2' ' A' ' 131' ' ' GLU . 22.1 mm -73.14 -98.18 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.769 -171.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.466 ' HG2' HG22 ' A' ' 136' ' ' ILE . 8.4 mm-40 -90.67 49.04 1.61 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.0 0.429 . . . . 0.0 111.319 -176.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.5 m -97.82 62.67 1.63 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.67 0.747 . . . . 0.0 109.984 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 21.7 tp -128.36 103.72 7.31 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.129 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -108.26 -46.12 3.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.555 -171.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 22.1 pt . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.85 -179.02 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.8 m . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.961 0.41 . . . . 0.0 110.294 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 95.8 mt -120.37 104.63 10.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.1 0.476 . . . . 0.0 110.84 -178.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -92.25 65.58 4.65 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -85.5 -60.84 1.91 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.204 -170.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -78.91 -156.1 0.1 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -174.076 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.8 m -73.64 21.6 0.08 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -176.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -131.24 87.62 2.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.021 0.438 . . . . 0.0 110.596 175.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -115.85 -2.18 20.73 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.364 -0.695 . . . . 0.0 111.364 175.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.8 t -168.68 48.9 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.781 0.8 . . . . 0.0 109.596 -177.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.8 -62.11 3.36 Favored Glycine 0 N--CA 1.451 -0.332 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 -171.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.774 HG12 ' H ' ' A' ' 25' ' ' ALA . 10.4 t -120.85 -137.41 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 167.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.774 ' H ' HG12 ' A' ' 24' ' ' VAL . . . -148.04 -76.97 0.17 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.883 HD21 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -106.54 -21.98 12.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.599 177.887 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.43 ' N ' HD13 ' A' ' 26' ' ' LEU . . . 139.41 111.75 0.98 Allowed Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.383 175.793 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.507 ' HG2' ' CG1' ' A' ' 24' ' ' VAL . 24.1 mmt180 -56.87 -73.32 0.07 Allowed 'General case' 0 C--O 1.233 0.214 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 172.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.522 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 31.0 p-10 -99.31 159.61 14.88 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.851 -172.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.624 ' CD ' ' H ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -84.37 110.27 25.52 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.229 -165.149 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.566 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.6 Cg_exo -70.75 -162.91 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 124.056 3.171 . . . . 0.0 112.666 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.684 ' H ' HD12 ' A' ' 32' ' ' LEU . 6.5 mp -41.52 139.25 1.15 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.408 0.683 . . . . 0.0 112.798 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.981 ' HE2' ' HG2' ' A' ' 90' ' ' GLN . 2.3 mptp? -89.8 74.45 7.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.629 -176.039 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.92 -15.4 19.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.446 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.41 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 19.9 tt0 -77.03 156.91 31.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.491 0.662 . . . . 0.0 111.008 -178.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.425 ' H ' ' HG2' ' A' ' 36' ' ' LYS . 8.5 pttt -94.97 159.23 33.57 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.038 -172.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HB2' HG12 ' A' ' 120' ' ' VAL . 12.2 Cg_exo -68.86 144.83 60.34 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.055 1.837 . . . . 0.0 111.296 174.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.699 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 31.9 ttpt -111.04 145.19 38.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.303 -170.957 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 1.051 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.0 OUTLIER 134.75 -9.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 O-C-N 125.429 1.706 . . . . 0.0 109.775 -179.348 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.614 ' HG2' HG11 ' A' ' 120' ' ' VAL . 0.0 OUTLIER -113.61 168.89 9.38 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.386 0.612 . . . . 0.0 111.396 -171.049 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.2 m -85.82 133.13 33.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.287 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.3 -27.85 66.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.444 0.64 . . . . 0.0 109.338 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -141.43 84.4 12.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.892 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.49 144.36 60.83 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.825 2.35 . . . . 0.0 111.805 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.598 ' O ' HG22 ' A' ' 130' ' ' ILE . 0.0 OUTLIER -127.21 -135.25 0.24 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.279 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.818 HG22 HD12 ' A' ' 136' ' ' ILE . 69.0 p -73.1 170.05 15.73 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -171.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 20.4 t70 -55.15 -37.88 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.617 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.44 -36.59 63.97 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.109 177.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 85.3 mm-40 -75.42 -39.16 59.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.75 ' HB2' HG21 ' A' ' 130' ' ' ILE . 54.8 tp -58.66 -53.18 61.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.903 178.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 16.4 ptp180 -60.72 -46.83 88.9 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.082 -178.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 18.2 m -65.2 -47.66 76.14 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.947 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.594 ' C ' ' HD2' ' A' ' 53' ' ' LYS . 4.5 tmmm? -56.95 -45.75 82.59 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.135 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -53.5 -53.47 50.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.429 -174.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.1 -50.4 48.48 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.051 0.453 . . . . 0.0 111.147 -177.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 1.7 tm-20 -54.56 -49.87 69.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.836 -177.549 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.411 ' CE1' ' HG2' ' A' ' 53' ' ' LYS . 12.1 m-85 -71.48 -39.05 71.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.622 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.493 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 1.9 m95 -56.91 -23.08 42.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . 0.488 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 7.5 t70 -65.9 -37.24 85.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.858 0.361 . . . . 0.0 111.351 173.519 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.2 m -107.91 -22.08 12.58 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -169.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.598 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -60.46 -59.19 14.63 Favored Pre-proline 0 CA--C 1.538 0.512 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.272 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.598 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 88.0 Cg_endo -78.41 -8.06 16.07 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.073 1.849 . . . . 0.0 112.953 -174.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 67.17 -150.79 0.18 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.166 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -88.37 -43.38 11.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.04 0.448 . . . . 0.0 110.41 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -179.19 -175.87 0.39 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.072 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.436 ' HA3' ' CZ ' ' A' ' 116' ' ' TYR . . . -162.81 -168.52 24.87 Favored Glycine 0 N--CA 1.44 -1.073 0 N-CA-C 111.421 -0.672 . . . . 0.0 111.421 175.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 67' ' ' ARG . 68.6 mmt-85 -102.9 116.69 33.03 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.411 ' HD2' ' OE1' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -77.63 -15.92 58.88 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.776 0.322 . . . . 0.0 110.807 -177.668 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.411 ' OE1' ' HD2' ' A' ' 68' ' ' LYS . 6.8 mp0 -60.57 -41.98 95.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.244 175.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.563 ' O ' HG12 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -82.98 -19.84 9.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.36 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.52 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -46.57 -41.42 14.41 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 122.569 0.348 . . . . 0.0 111.891 -176.241 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.504 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 10.4 m-20 -59.8 -32.63 70.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.18 -35.15 66.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.09 0.471 . . . . 0.0 109.919 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.419 HD21 HD13 ' A' ' 70' ' ' ILE . 25.4 mt -66.22 -48.65 69.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.594 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 14.3 ptpt -68.78 -28.03 66.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.855 179.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -73.2 -36.9 66.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.916 0.388 . . . . 0.0 110.672 176.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.67 -48.0 65.06 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.475 176.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -52.76 -34.3 52.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.826 172.055 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.414 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 35.4 t60 -64.4 -51.9 60.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.948 0.404 . . . . 0.0 109.929 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.438 ' HB1' ' HB2' ' A' ' 88' ' ' LEU . . . -64.1 -55.56 21.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.187 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -52.68 -34.81 53.64 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.642 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.012 0.434 . . . . 0.0 111.395 176.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 7.1 t -85.31 15.55 4.27 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.441 ' HB2' ' O ' ' A' ' 83' ' ' SER . 36.3 m-80 73.6 5.18 4.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.589 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 80' ' ' ALA . 1.7 m-20 -77.21 84.62 3.68 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.859 0.837 . . . . 0.0 110.584 176.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.662 ' HE2' ' HA ' ' A' ' 32' ' ' LEU . 12.6 t-80 -70.36 -39.59 74.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.256 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -60.28 -44.0 95.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.387 -178.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.441 ' O ' HG13 ' A' ' 92' ' ' ILE . 12.7 mt -63.71 -51.48 64.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.736 -177.425 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.588 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -60.55 -39.29 87.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.605 -175.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.981 ' HG2' ' HE2' ' A' ' 33' ' ' LYS . 9.2 mt-30 -65.46 -43.67 89.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.705 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -21.17 64.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.029 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.4 mt -82.12 -60.94 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.505 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 89' ' ' ALA . 9.3 mm -55.23 -54.34 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.829 0.347 . . . . 0.0 111.253 178.612 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.48 -33.19 75.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.273 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -69.97 -14.44 70.72 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.225 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -95.99 3.72 53.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 84.5 m-20 75.89 7.6 3.69 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.688 0.617 . . . . 0.0 109.621 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.915 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -89.94 139.47 17.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.036 -0.984 . . . . 0.0 109.831 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 p -124.26 162.74 23.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.222 0.535 . . . . 0.0 111.619 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.72 HD13 ' H ' ' A' ' 102' ' ' HIS . 1.7 tm? -150.1 109.83 3.25 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.463 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.883 ' HB2' HD21 ' A' ' 26' ' ' LEU . 38.0 Cg_endo -64.71 -24.01 62.61 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.185 2.59 . . . . 0.0 113.655 -172.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.72 ' H ' HD13 ' A' ' 100' ' ' LEU . 11.3 m170 -76.29 -18.75 58.81 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.784 0.325 . . . . 0.0 111.283 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.566 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 80.51 11.68 83.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.702 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.581 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -93.29 152.02 19.43 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.297 0.57 . . . . 0.0 111.56 -173.439 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.885 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 2.8 tm? -84.89 -23.36 28.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.209 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.443 HG21 ' HG3' ' A' ' 37' ' ' PRO . 47.0 p -88.46 17.62 5.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.53 -174.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.604 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 66.4 mt-10 -150.5 143.21 24.57 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 81.8 m -152.01 139.24 19.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.886 0.374 . . . . 0.0 111.519 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.559 ' HE1' ' HG3' ' A' ' 115' ' ' ARG . 19.7 m-30 -118.94 122.02 41.27 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.469 0.652 . . . . 0.0 109.46 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.965 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.9 t70 -83.32 145.42 29.08 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.009 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.89 -27.49 60.68 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 124.451 1.095 . . . . 0.0 112.271 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.0 mt -76.47 -11.91 59.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.453 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.66 30.22 3.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.253 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.965 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 57.3 m-80 -98.76 157.92 15.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.744 0.307 . . . . 0.0 110.952 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.559 ' HG3' ' HE1' ' A' ' 109' ' ' TYR . 11.4 ttm180 -134.53 122.53 22.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 -174.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' TYR . . . . . 0.482 ' C ' HE21 ' A' ' 117' ' ' GLN . 38.5 m-85 -120.85 124.8 45.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.375 175.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.482 HE21 ' C ' ' A' ' 116' ' ' TYR . 2.3 mm-40 -122.34 121.37 36.55 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.523 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.489 HD23 HD11 ' A' ' 123' ' ' LEU . 21.5 tp -98.65 122.2 53.98 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -166.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.568 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 11.2 Cg_exo -74.84 157.38 43.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.974 3.116 . . . . 0.0 113.215 177.715 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.051 HG22 ' HE1' ' A' ' 39' ' ' TRP . 20.4 m -72.58 -10.03 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.798 -175.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.568 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.1 p90 -56.24 -24.11 40.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -170.407 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 52.2 t -113.4 3.53 15.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.74 0.305 . . . . 0.0 111.111 -176.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.489 HD11 HD23 ' A' ' 118' ' ' LEU . 20.0 mt -125.47 -53.61 1.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.848 0.356 . . . . 0.0 111.842 -174.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.623 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -136.15 111.59 10.13 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.691 0.281 . . . . 0.0 110.764 -176.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.511 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 11.1 Cg_endo -92.78 6.7 3.07 Favored 'Trans proline' 0 CA--C 1.559 1.764 0 C-N-CA 123.281 2.654 . . . . 0.0 117.379 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.623 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 17.4 Cg_endo -59.29 -31.57 95.32 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 122.921 2.079 . . . . 0.0 111.776 174.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.694 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -91.79 39.88 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.091 178.642 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 128' ' ' ASN . . . . . 0.411 HD22 ' C ' ' A' ' 128' ' ' ASN . 0.2 OUTLIER -109.13 -31.07 7.74 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.534 176.613 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 16.2 tpt -65.36 -42.94 92.25 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.963 0.411 . . . . 0.0 110.218 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.75 HG21 ' HB2' ' A' ' 50' ' ' LEU . 20.7 mm 73.26 -69.37 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.824 175.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 1.033 ' HB3' HG13 ' A' ' 136' ' ' ILE . 9.7 mt-10 -81.61 -172.3 3.78 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.406 -171.211 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.43 ' HB3' ' HD3' ' A' ' 133' ' ' LYS . 34.7 mt-10 -69.02 -175.62 0.76 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -178.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.507 ' HD3' ' H ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -52.13 -44.79 64.69 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.459 -176.92 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 134' ' ' SER . . . . . 0.406 ' N ' ' HG2' ' A' ' 133' ' ' LYS . 8.7 t 177.14 34.89 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -92.34 -21.83 20.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.615 -171.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 1.033 HG13 ' HB3' ' A' ' 131' ' ' GLU . 3.4 mm -82.38 157.75 3.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.405 -1.27 . . . . 0.0 110.871 -174.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 137' ' ' GLU . 14.0 mp0 -71.99 -17.75 62.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.9 -176.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.17 109.85 7.01 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.742 -177.339 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 23.2 tp -131.64 -65.75 0.75 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.882 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -93.18 -47.25 7.03 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 5.0 pt . . . . . 0 C--N 1.319 -0.752 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.868 179.494 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.6 t . . . . . 0 N--CA 1.477 0.88 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 91.9 mt 63.89 95.3 0.05 OUTLIER 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.513 0.508 . . . . 0.0 111.175 -177.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.64 ' OD1' ' HA ' ' A' ' 19' ' ' SER . 66.0 t30 -74.28 61.36 0.88 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.682 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -79.82 -44.71 20.05 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 50.9 t30 -97.31 102.43 14.2 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 166.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.64 ' HA ' ' OD1' ' A' ' 16' ' ' ASN . 23.2 t -61.71 134.34 56.66 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.217 -173.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.4 ' HB3' HG22 ' A' ' 22' ' ' THR . 43.2 tt0 -91.0 147.27 23.2 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.771 178.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -57.18 -8.45 3.38 Favored Glycine 0 C--N 1.335 0.486 0 CA-C-N 115.621 -0.718 . . . . 0.0 114.395 -175.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.4 HG22 ' HB3' ' A' ' 20' ' ' GLU . 8.6 t -59.19 -31.25 68.84 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.147 0.499 . . . . 0.0 110.174 172.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -113.76 -47.06 0.64 Allowed Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 174.4 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.733 HG11 ' H ' ' A' ' 28' ' ' ARG . 4.6 p 176.86 159.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 177.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 19' ' ' SER . . . -86.31 -82.47 0.2 Allowed 'General case' 0 C--N 1.297 -1.685 0 C-N-CA 120.33 -0.548 . . . . 0.0 112.002 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.809 HD13 ' H ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -76.88 -18.9 58.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.258 -174.937 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.536 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 127.15 104.31 1.29 Allowed Glycine 0 C--O 1.221 -0.688 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.247 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.733 ' H ' HG11 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -76.63 -19.63 57.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.039 0.447 . . . . 0.0 111.231 178.817 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.493 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -101.08 157.96 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.349 176.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.788 ' HB3' ' HA2' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -87.19 117.67 68.92 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -168.829 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.784 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 13.4 Cg_exo -72.17 -163.4 0.14 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.227 2.618 . . . . 0.0 111.476 164.833 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.455 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.2 mp -59.99 142.86 53.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.808 0.337 . . . . 0.0 110.985 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.552 ' HE3' ' HB2' ' A' ' 86' ' ' HIS . 0.0 OUTLIER -78.02 71.98 4.52 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.274 0.559 . . . . 0.0 111.586 -178.993 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -87.29 -17.3 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.547 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.27 169.56 17.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.528 0.68 . . . . 0.0 111.729 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -108.62 149.72 39.8 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.215 -176.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.614 ' HG3' HG21 ' A' ' 106' ' ' THR . 22.9 Cg_exo -60.8 138.75 81.35 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.566 2.177 . . . . 0.0 111.665 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.506 ' HE2' ' HB3' ' A' ' 38' ' ' LYS . 3.4 tmmm? -111.17 122.47 47.96 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.891 0.853 . . . . 0.0 112.761 -170.49 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 1.047 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.9 p-90 175.04 23.26 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 113.058 -1.883 . . . . 0.0 108.159 172.491 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.601 ' HE2' HG12 ' A' ' 127' ' ' ILE . 1.8 tmmt? -142.24 149.55 39.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.444 -156.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.502 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 57.7 m -66.75 119.64 12.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.373 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -64.54 -25.56 68.04 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -130.16 83.6 62.66 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.592 171.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.578 ' HB2' HG12 ' A' ' 130' ' ' ILE . 16.8 Cg_exo -70.03 141.38 43.96 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.636 2.224 . . . . 0.0 112.35 -178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -116.75 -135.63 0.35 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.572 ' CG2' HG21 ' A' ' 136' ' ' ILE . 37.3 p -72.93 -179.88 3.4 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.595 ' OD1' ' HB ' ' A' ' 136' ' ' ILE . 9.7 p-10 -65.68 -37.19 85.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.737 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.8 -38.82 96.71 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.026 -0.607 . . . . 0.0 111.633 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -71.68 -33.55 68.93 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.698 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 3.2 tm? -60.49 -52.7 64.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.322 178.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.48 ' HG3' ' N ' ' A' ' 52' ' ' SER . 6.6 ptm180 -65.1 -54.9 22.78 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -176.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.48 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 47.7 m -62.75 -50.9 69.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.421 -174.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.468 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 0.1 OUTLIER -67.94 -28.37 67.41 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.903 -177.718 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.698 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.2 -39.48 94.75 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.801 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.82 -48.32 66.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.243 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.03 -52.41 43.32 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.468 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 17.8 m-85 -59.97 -40.04 87.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.531 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -25.0 61.41 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -73.72 -32.47 63.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.115 0.483 . . . . 0.0 110.859 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 m -92.32 -23.43 19.26 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.324 -174.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.682 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -59.98 -67.02 1.15 Allowed Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.682 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 88.8 Cg_endo -77.86 -37.25 0.91 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.52 1.48 . . . . 0.0 112.462 -175.16 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 58.36 -90.15 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 171.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -107.76 -7.52 16.33 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -168.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 59.17 -158.46 0.31 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.758 0.314 . . . . 0.0 110.187 -174.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLY . . . . . 0.506 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . 179.75 -138.46 3.44 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.786 177.306 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.688 ' HB3' HG22 ' A' ' 70' ' ' ILE . 7.7 tpt180 -81.12 112.75 18.77 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.567 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 14.3 tptm -61.57 -33.02 73.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.915 0.388 . . . . 0.0 110.584 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.72 -45.18 82.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.62 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.688 HG22 ' HB3' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -77.27 -21.18 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.198 -177.507 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.567 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.32 -42.92 22.23 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.28 0.562 . . . . 0.0 111.208 -176.563 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASP . . . . . 0.549 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 7.9 m-20 -66.04 -25.57 67.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.894 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.6 -29.78 46.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.4 0.619 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.419 HD21 ' CD1' ' A' ' 70' ' ' ILE . 17.2 mt -70.19 -51.2 32.92 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.506 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.549 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 13.2 ptpt -64.89 -32.74 74.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.867 178.459 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.26 -35.57 73.88 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.752 0.311 . . . . 0.0 110.945 176.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -68.87 -46.91 67.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.484 176.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.572 ' HB1' HD21 ' A' ' 123' ' ' LEU . . . -52.59 -36.02 55.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.419 173.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.526 ' O ' ' HB2' ' A' ' 82' ' ' GLU . 63.6 t60 -62.98 -47.09 84.65 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.342 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.06 -51.32 59.26 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.56 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.551 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 1.8 t80 -54.04 -34.7 60.72 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.891 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 28.6 mt-10 -51.37 -48.72 62.43 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 175.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.561 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 15.2 m -76.41 -19.69 57.85 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.731 -173.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' A' ' 83' ' ' SER . 9.7 t30 138.93 -17.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.226 0 O-C-N 124.947 1.405 . . . . 0.0 109.846 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.589 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 0.2 OUTLIER -71.73 90.63 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -165.106 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.704 ' O ' ' HG2' ' A' ' 90' ' ' GLN . 27.4 t-80 -70.45 -44.99 66.66 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.011 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLU . . . . . 0.508 ' H ' ' CD ' ' A' ' 87' ' ' GLU . 1.7 pm0 -62.96 -47.03 84.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.73 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.525 ' O ' HG13 ' A' ' 92' ' ' ILE . 4.2 mt -54.45 -56.36 19.52 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.251 0.548 . . . . 0.0 110.838 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.795 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -61.31 -42.64 99.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.766 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.704 ' HG2' ' O ' ' A' ' 86' ' ' HIS . 22.6 mm-40 -63.74 -38.45 91.14 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.171 -0.211 . . . . 0.0 111.18 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.77 -30.77 69.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.906 0.384 . . . . 0.0 110.284 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 88' ' ' LEU . 57.2 mt -69.71 -59.97 2.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.851 178.084 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.567 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.5 mm -52.4 -57.17 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.134 0.492 . . . . 0.0 111.005 178.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -64.56 -24.49 67.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.042 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.57 -19.2 68.78 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.697 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -101.53 4.24 40.89 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.692 -0.299 . . . . 0.0 110.603 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 3.7 m-20 72.9 8.11 5.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.565 0.698 . . . . 0.0 110.107 -174.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.968 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.6 mp -82.05 136.92 22.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.82 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.521 ' HA ' ' OE1' ' A' ' 30' ' ' GLN . 25.6 p -138.61 171.18 14.73 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.409 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.784 HD13 ' H ' ' A' ' 102' ' ' HIS . 1.5 tm? -148.52 114.33 3.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.582 ' HD2' HD22 ' A' ' 100' ' ' LEU . 34.7 Cg_endo -65.13 -17.62 59.32 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.492 2.795 . . . . 0.0 114.558 -174.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.784 ' H ' HD13 ' A' ' 100' ' ' LEU . 18.8 m-70 -79.93 -23.22 41.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.179 0.514 . . . . 0.0 111.033 177.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.788 ' HA2' ' HB3' ' A' ' 30' ' ' GLN . . . 75.99 17.29 80.12 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.392 -0.909 . . . . 0.0 111.567 -172.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -94.96 141.38 28.72 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 121.168 0.509 . . . . 0.0 110.406 -176.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.795 HD21 ' HB1' ' A' ' 89' ' ' ALA . 0.3 OUTLIER -75.29 -21.63 58.34 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.9 -1.046 . . . . 0.0 109.005 179.122 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.614 HG21 ' HG3' ' A' ' 37' ' ' PRO . 64.4 p -90.71 15.05 11.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.936 -173.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.585 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.4 mt-10 -148.55 143.87 26.91 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 175.034 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.8 m -150.75 139.17 20.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.524 0.202 . . . . 0.0 110.523 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -118.92 123.16 43.96 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.343 0.592 . . . . 0.0 109.967 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 0.968 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.3 t70 -87.11 147.22 25.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.503 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.55 -24.71 57.63 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.112 -172.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.4 ' HG ' ' OD1' ' A' ' 110' ' ' ASP . 27.4 mt -76.71 -3.04 35.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 110.938 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.11 34.39 6.48 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 0.787 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 11.6 m120 -106.6 157.88 17.35 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -139.95 139.16 36.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.229 0.537 . . . . 0.0 110.942 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' TYR . . . . . 0.424 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 40.1 m-85 -124.91 127.75 47.57 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.921 175.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -121.38 122.52 40.01 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -176.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.456 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 30.8 tp -102.53 123.29 43.28 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.065 -167.915 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.653 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 20.4 Cg_exo -69.48 155.76 65.94 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.737 2.958 . . . . 0.0 112.751 176.138 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 1.047 HG22 ' HE1' ' A' ' 39' ' ' TRP . 20.2 m -66.17 -17.71 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.656 -175.167 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.653 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.3 p90 -60.65 -22.14 63.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -166.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.7 t -110.59 1.48 18.1 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.601 -174.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.572 HD21 ' HB1' ' A' ' 78' ' ' ALA . 90.3 mt -130.31 -37.02 1.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 0.0 111.808 -177.114 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.427 ' HB3' ' HB ' ' A' ' 120' ' ' VAL . . . -117.46 112.53 39.19 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.439 -175.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.552 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 51.3 Cg_exo -56.38 -34.91 95.51 Favored 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.648 2.899 . . . . 0.0 115.674 177.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 48.8 Cg_endo -67.31 -149.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.365 1.444 0 C-N-CA 121.778 1.652 . . . . 0.0 112.459 175.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.601 HG12 ' HE2' ' A' ' 40' ' ' LYS . 4.0 mp 52.93 52.63 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.146 0 CA-C-O 122.383 1.087 . . . . 0.0 109.759 -174.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -147.68 106.59 3.84 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.002 -175.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 51.8 ttp 69.21 111.3 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 O-C-N 124.069 0.856 . . . . 0.0 111.159 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.578 HG12 ' HB2' ' A' ' 44' ' ' PRO . 4.0 mp -101.33 -65.27 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.108 -177.091 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -113.14 82.78 1.72 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.31 0.576 . . . . 0.0 109.935 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 60.82 -176.4 0.11 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 114.722 -1.126 . . . . 0.0 112.765 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.954 ' HD3' ' H ' ' A' ' 133' ' ' LYS . 2.1 mppt? -61.91 -65.3 0.71 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 122.037 0.922 . . . . 0.0 110.3 -175.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 5.3 p -170.1 48.58 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 113.893 -1.503 . . . . 0.0 107.267 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -94.79 -29.44 14.75 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.15 -172.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.595 ' HB ' ' OD1' ' A' ' 47' ' ' ASP . 28.3 mm -68.33 -86.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.514 -174.066 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -76.16 41.31 0.23 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -174.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 16.5 m -111.18 57.83 0.62 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 122.036 0.922 . . . . 0.0 108.619 171.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.4 tp -91.36 -0.74 57.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.634 -1.167 . . . . 0.0 109.247 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 29.5 t70 77.59 28.34 0.58 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 122.597 1.189 . . . . 0.0 108.661 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 27.3 pt . . . . . 0 C--N 1.316 -0.864 0 CA-C-N 114.001 -1.454 . . . . 0.0 110.077 175.642 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.6 m . . . . . 0 N--CA 1.477 0.887 0 CA-C-O 120.739 0.304 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.09 105.98 17.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.764 0.316 . . . . 0.0 110.579 -178.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -114.95 118.84 34.58 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -136.97 150.71 48.33 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.039 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 66.0 t30 73.91 -13.72 0.73 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 124.019 0.825 . . . . 0.0 111.922 174.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 22' ' ' THR . 6.3 p -82.78 51.57 1.93 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.18 0.514 . . . . 0.0 111.03 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -81.15 112.53 18.59 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.701 -177.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.14 14.35 62.54 Favored Glycine 0 CA--C 1.507 -0.424 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.245 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.425 ' O ' ' HB2' ' A' ' 19' ' ' SER . 3.2 t -153.39 92.08 1.56 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.328 0.585 . . . . 0.0 109.669 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -69.98 80.9 0.35 Allowed Glycine 0 C--N 1.332 0.309 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.489 -177.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.805 HG21 ' HG3' ' A' ' 28' ' ' ARG . 78.7 t -124.14 -71.88 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.552 0.215 . . . . 0.0 110.626 -177.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -176.13 -66.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.739 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.476 HD22 ' H ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -121.6 -10.91 8.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.713 172.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.61 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 113.04 110.11 2.98 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.712 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.805 ' HG3' HG21 ' A' ' 24' ' ' VAL . 10.8 mtm180 -56.41 -52.01 66.24 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.036 0.446 . . . . 0.0 110.751 177.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.452 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 26.1 p-10 -91.1 156.75 17.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.621 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.877 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 3.7 pm0 -88.78 118.16 69.03 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 121.787 0.804 . . . . 0.0 112.219 -170.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.664 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 5.2 Cg_exo -77.4 -164.38 0.26 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.493 2.795 . . . . 0.0 111.435 169.517 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.537 ' HG ' ' NE2' ' A' ' 86' ' ' HIS . 7.7 tt -40.82 120.71 1.35 Allowed 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 173.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LYS . . . . . 0.779 ' HB3' ' H ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -56.83 121.75 10.6 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 121.473 0.654 . . . . 0.0 111.655 -177.426 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -95.2 -33.92 12.43 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.395 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.14 170.1 12.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.516 174.269 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -110.53 162.37 20.83 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.56 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.56 ' HB2' HG12 ' A' ' 120' ' ' VAL . 22.0 Cg_exo -59.98 123.26 12.83 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.625 1.55 . . . . 0.0 110.839 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 3.4 tmmm? -108.09 122.14 46.28 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.891 0.853 . . . . 0.0 112.207 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' TRP . . . . . 0.999 ' HE1' HG22 ' A' ' 120' ' ' VAL . 2.5 p-90 171.08 24.27 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.795 -2.002 . . . . 0.0 107.882 177.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.573 ' HD2' ' N ' ' A' ' 41' ' ' SER . 1.2 tmmt? -141.13 152.88 45.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.298 -153.742 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . 0.573 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 48.2 m -64.62 127.29 30.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.447 -177.219 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -61.72 -29.54 70.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.86 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -147.56 95.95 4.21 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.693 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.52 129.02 13.24 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.667 2.244 . . . . 0.0 111.866 176.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' MET . . . . . 0.633 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.6 mtp -94.27 -85.27 0.3 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.057 -179.193 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.0 p -114.85 -178.16 3.3 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.423 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . 0.521 ' HB3' ' HG2' ' A' ' 131' ' ' GLU . 9.0 p-10 -69.22 -33.36 73.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.81 0.338 . . . . 0.0 110.336 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.71 -38.05 95.62 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.619 176.556 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.633 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 15.7 mm100 -70.94 -41.54 71.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.856 0.36 . . . . 0.0 110.181 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.434 ' HG ' ' H ' ' A' ' 130' ' ' ILE . 1.0 OUTLIER -57.74 -50.42 73.27 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.455 -179.043 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 7.2 ptm180 -66.51 -42.41 87.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.7 t -65.61 -52.08 54.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.924 0.392 . . . . 0.0 110.286 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.45 ' HG3' ' CE2' ' A' ' 57' ' ' PHE . 3.4 tppt? -63.1 -35.28 79.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.431 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -56.81 -46.94 81.29 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.902 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.48 -46.11 73.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.003 0.43 . . . . 0.0 110.86 -177.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -53.44 -49.57 67.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.799 175.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.45 ' CE2' ' HG3' ' A' ' 53' ' ' LYS . 19.0 m-85 -63.22 -43.91 96.76 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.1 176.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' TRP . . . . . 0.655 ' HZ3' ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -49.6 -36.06 22.89 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 178.718 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -70.16 -26.12 63.77 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.6 m -96.12 -24.31 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.757 0.789 . . . . 0.0 109.821 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.539 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -68.32 159.18 82.02 Favored Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.405 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.539 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 21.4 Cg_endo -82.9 -9.52 10.79 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.99 2.46 . . . . 0.0 112.713 -173.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.655 ' HA ' ' HZ3' ' A' ' 58' ' ' TRP . . . 59.5 -141.75 0.63 Allowed 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.894 -177.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -103.38 0.54 31.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.092 0.472 . . . . 0.0 109.869 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -68.56 161.24 28.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.937 -175.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 123.28 179.03 15.66 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.576 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 67' ' ' ARG . 37.7 mtt180 -65.89 109.75 2.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.962 0.41 . . . . 0.0 110.266 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.748 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 72.9 mmtt -64.84 -23.41 67.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.681 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLU . . . . . 0.401 ' HG3' ' H ' ' A' ' 69' ' ' GLU . 22.6 mt-10 -52.51 -53.63 43.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.031 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.772 HG13 HD13 ' A' ' 98' ' ' ILE . 0.0 OUTLIER -82.84 -25.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.668 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 71' ' ' TRP . . . . . 0.748 ' HB2' ' HA ' ' A' ' 68' ' ' LYS . 5.9 m95 -52.41 -35.95 53.14 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.053 177.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -55.68 -39.35 70.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.426 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.35 -28.76 37.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 110.382 -175.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.49 HD21 ' CD1' ' A' ' 70' ' ' ILE . 21.8 mt -64.65 -49.87 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.25 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.635 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 10.7 ptpt -73.43 -26.68 61.05 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.093 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -67.33 -41.11 85.77 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.895 0.379 . . . . 0.0 110.636 175.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -66.94 -50.93 60.82 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.206 176.121 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ALA . . . . . 0.586 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -51.29 -32.89 26.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.733 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.488 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 65.5 t60 -62.56 -50.67 70.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.894 0.378 . . . . 0.0 110.468 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.08 -52.06 52.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.559 177.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.466 ' CE1' ' HD2' ' A' ' 33' ' ' LYS . 10.4 t80 -55.68 -26.79 46.65 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.32 178.215 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.586 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.0 mt-10 -57.22 -34.56 68.68 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.671 -0.643 . . . . 0.0 110.785 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.5 t -90.77 16.62 8.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.461 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.8 t30 70.68 8.52 6.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.397 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.58 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 11.0 t0 -76.07 93.37 3.3 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.784 -177.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' HIS . . . . . 0.641 ' O ' ' HG3' ' A' ' 90' ' ' GLN . 66.2 m80 -71.37 -50.79 28.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.777 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -58.61 -40.65 83.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.191 -171.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.535 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.8 mt -59.01 -52.48 65.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.89 0.376 . . . . 0.0 110.812 176.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.891 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -65.59 -40.02 92.22 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.467 -175.173 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' A' ' 86' ' ' HIS . 19.9 mt-30 -58.08 -46.59 85.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.468 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.15 -25.08 60.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.724 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 88' ' ' LEU . 46.4 mt -69.91 -59.43 3.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.641 0.258 . . . . 0.0 110.628 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ILE . . . . . 0.534 ' CG2' HG22 ' A' ' 98' ' ' ILE . 10.6 mm -53.04 -59.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.301 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -63.93 -25.26 68.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.364 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.97 56.11 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.622 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . 0.624 ' HB3' HD12 ' A' ' 98' ' ' ILE . . . -112.41 15.89 20.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 122.548 -0.384 . . . . 0.0 111.574 -179.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 72.2 9.72 5.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 122.041 0.924 . . . . 0.0 108.948 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ILE . . . . . 0.772 HD13 HG13 ' A' ' 70' ' ' ILE . 50.3 mt -96.25 138.03 22.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.594 -176.208 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' THR . . . . . 0.633 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 34.3 p -139.13 168.66 19.34 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.227 -0.589 . . . . 0.0 112.178 -170.496 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LEU . . . . . 0.92 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.7 tm? -149.38 99.62 3.39 Favored Pre-proline 0 N--CA 1.452 -0.354 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.086 174.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' PRO . . . . . 0.61 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 56.0 Cg_endo -66.68 -10.72 29.07 Favored 'Trans proline' 0 N--CA 1.475 0.383 0 C-N-CA 123.433 2.756 . . . . 0.0 113.29 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' HIS . . . . . 0.679 ' H ' HD13 ' A' ' 100' ' ' LEU . 48.8 m170 -84.02 -9.85 58.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.702 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLY . . . . . 0.664 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 67.84 38.15 89.03 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.623 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ALA . . . . . 0.92 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -122.67 139.39 54.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.287 0.565 . . . . 0.0 111.391 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.891 HD21 ' HB1' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -76.9 -22.08 53.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.043 -0.98 . . . . 0.0 108.412 176.625 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.578 HG22 HD13 ' A' ' 123' ' ' LEU . 59.1 p -91.84 18.11 8.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.606 -172.183 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.7 mt-10 -150.62 149.14 29.49 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 171.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.445 ' SG ' HD22 ' A' ' 74' ' ' LEU . 80.6 m -150.55 144.09 25.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.798 0.332 . . . . 0.0 110.416 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' TYR . . . . . 0.642 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 18.0 m-30 -118.48 121.73 40.99 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.093 0.473 . . . . 0.0 109.835 177.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASP . . . . . 1.051 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.3 t70 -79.78 145.18 32.98 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.597 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -59.6 -24.47 63.82 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.967 -168.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 mt -76.82 -13.73 59.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.118 0.485 . . . . 0.0 110.495 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.23 28.05 3.2 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.452 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASN . . . . . 1.051 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 51.5 m-80 -94.1 143.01 26.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.794 0.297 . . . . 0.0 110.766 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.642 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 53.2 ttp180 -123.3 121.19 35.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.579 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -127.16 140.7 52.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.942 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLN . . . . . 0.458 ' O ' ' HG3' ' A' ' 62' ' ' PRO . 24.8 mt-30 -123.11 146.36 47.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LEU . . . . . 0.706 HD12 ' HD2' ' A' ' 119' ' ' PRO . 15.8 tp -111.96 121.98 38.15 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -167.227 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.706 ' HD2' HD12 ' A' ' 118' ' ' LEU . 14.5 Cg_exo -72.13 157.49 54.01 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.847 3.031 . . . . 0.0 113.372 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' VAL . . . . . 0.999 HG22 ' HE1' ' A' ' 39' ' ' TRP . 9.3 m -69.62 -14.41 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.385 -175.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' TYR . . . . . 0.586 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -56.46 -22.3 31.28 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -168.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 40.7 t -124.75 16.41 8.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.818 0.342 . . . . 0.0 110.919 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' LEU . . . . . 0.578 HD13 HG22 ' A' ' 106' ' ' THR . 72.7 mt -131.63 -54.34 1.01 Allowed 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.138 -0.351 . . . . 0.0 111.705 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.528 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -129.98 111.74 17.17 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.828 0.346 . . . . 0.0 110.583 -175.131 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 125' ' ' PRO . . . . . 0.44 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 89.8 Cg_endo -87.54 -4.67 7.4 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.029 2.486 . . . . 0.0 117.787 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' PRO . . . . . 0.528 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 30.6 Cg_endo -63.89 -26.31 67.14 Favored 'Trans proline' 0 C--N 1.371 1.734 0 CA-C-N 123.076 2.134 . . . . 0.0 112.499 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' ILE . . . . . 0.786 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.2 OUTLIER -105.6 45.52 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.438 0.637 . . . . 0.0 110.107 179.269 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -79.4 -56.54 4.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.898 -172.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 16.5 tpt -152.84 86.3 1.25 Allowed 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' ILE . . . . . 0.434 ' H ' ' HG ' ' A' ' 50' ' ' LEU . 33.2 mm -71.28 146.39 11.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.629 -177.672 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 131' ' ' GLU . . . . . 0.521 ' HG2' ' HB3' ' A' ' 47' ' ' ASP . 19.2 mt-10 -139.34 -156.49 0.68 Allowed 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.086 -176.279 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' GLU . . . . . 0.536 ' HB2' HD11 ' A' ' 136' ' ' ILE . 3.8 mm-40 -65.58 -173.7 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.44 -178.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LYS . . . . . 0.485 ' HB3' ' NZ ' ' A' ' 133' ' ' LYS . 6.6 ttpm? -46.09 -72.96 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.364 -1.289 . . . . 0.0 112.769 -176.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 7.7 t -175.25 25.98 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.089 0.947 . . . . 0.0 108.605 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -100.51 -13.54 18.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.591 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' ILE . . . . . 0.536 HD11 ' HB2' ' A' ' 132' ' ' GLU . 32.8 mm -51.54 134.61 12.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.516 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 137' ' ' GLU . . . . . 0.515 ' O ' HD12 ' A' ' 139' ' ' LEU . 9.9 pt-20 37.34 77.32 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 O-C-N 124.271 0.982 . . . . 0.0 111.584 -170.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 5.0 m -54.36 107.64 0.3 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.595 -176.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 137' ' ' GLU . 7.8 mp -73.02 134.88 44.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.054 0.454 . . . . 0.0 111.15 179.093 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -95.43 -25.6 16.19 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 172.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 3.7 pt . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.685 177.91 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.55 ' O ' ' HB ' ' A' ' 99' ' ' THR . 2.4 ppt_? . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.403 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 3.5 p-10 -94.89 149.2 21.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 173.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.782 ' HG3' ' HA2' ' A' ' 103' ' ' GLY . 7.9 tt0 -83.62 119.09 73.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -165.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.535 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 5.8 Cg_exo -78.6 -164.53 0.28 Allowed 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.876 3.051 . . . . 0.0 112.125 171.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp -52.3 132.78 34.46 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 122.777 0.431 . . . . 0.0 111.183 178.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.727 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -80.76 87.81 5.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.273 0.559 . . . . 0.0 111.435 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.669 ' HD2' ' N ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -98.5 -25.06 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.106 175.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.669 ' N ' ' HD2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -50.73 151.32 2.45 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.389 -178.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.721 ' H ' ' HD2' ' A' ' 36' ' ' LYS . 1.2 mptt -96.05 159.95 31.06 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.681 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.605 ' HB2' HG12 ' A' ' 120' ' ' VAL . 13.8 Cg_exo -67.44 135.88 37.93 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.88 1.72 . . . . 0.0 111.063 174.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.65 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 32.5 ttpt -111.71 141.47 45.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.276 -0.42 . . . . 0.0 112.078 -168.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 1.071 ' HE1' HG22 ' A' ' 120' ' ' VAL . 3.1 p-90 147.51 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 O-C-N 125.281 1.613 . . . . 0.0 110.357 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.603 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.73 171.28 7.68 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.042 -176.847 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.467 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 15.0 m -64.61 133.28 51.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.776 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -71.43 -31.86 67.7 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -129.51 85.24 59.38 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.84 170.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.467 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 4.3 Cg_exo -75.86 134.23 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.417 2.078 . . . . 0.0 110.534 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.703 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 90.8 mtp -102.98 -81.99 0.5 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.963 0.411 . . . . 0.0 110.699 -178.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 75.4 p -115.37 -177.12 3.07 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.218 178.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -53.14 -49.64 66.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.263 0.352 . . . . 0.0 111.197 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.57 -48.03 84.16 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.127 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.703 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 75.3 mm-40 -61.82 -45.08 95.38 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 57.5 tp -58.98 -57.35 13.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.621 179.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.8 ptm180 -63.51 -45.05 92.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.6 m -64.79 -53.02 53.59 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 121.23 -0.188 . . . . 0.0 111.013 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.419 -0.513 . . . . 0.0 111.269 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.556 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 45.6 ttp180 -53.34 -53.52 49.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.658 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -66.26 -43.71 85.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.69 -177.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -51.7 -52.24 49.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.241 176.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -71.38 -36.86 71.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.69 0.281 . . . . 0.0 110.728 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.556 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -49.83 -41.61 45.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.587 176.539 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -58.22 -28.57 64.97 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.723 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.7 m -103.05 -0.22 31.07 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.458 -172.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.776 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -75.58 -75.58 0.1 OUTLIER Pre-proline 0 CA--C 1.544 0.737 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -173.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.776 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 77.7 Cg_endo . . . . . 0 C--N 1.352 0.73 0 C-N-CA 121.389 1.392 . . . . 0.0 113.478 -167.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.429 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.447 -0.569 0 N-CA-C 114.375 0.51 . . . . 0.0 114.375 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.715 ' HB3' HG22 ' A' ' 70' ' ' ILE . 13.1 tpt180 -155.76 106.95 2.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.729 0.299 . . . . 0.0 110.385 -169.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.518 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 75.7 mmtt -63.76 -28.36 69.83 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.351 0.596 . . . . 0.0 109.708 174.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HB2' ' HG3' ' A' ' 67' ' ' ARG . 18.1 mm-40 -59.63 -40.15 86.66 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.634 177.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.715 HG22 ' HB3' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -82.68 -23.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.991 -178.586 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.67 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -48.71 -38.42 21.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.799 -177.258 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -52.6 -40.98 63.25 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.196 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 -32.91 59.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.266 0.555 . . . . 0.0 110.294 -176.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.505 HD22 ' SG ' ' A' ' 108' ' ' CYS . 32.4 mt -68.4 -43.72 76.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.929 -175.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.3 ptpt -74.56 -30.45 61.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.451 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.36 -35.68 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.967 0.413 . . . . 0.0 110.483 175.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.0 -45.09 75.06 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.352 176.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.607 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -50.04 -39.33 41.54 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.57 0.544 . . . . 0.0 110.805 171.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.447 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 71.3 t60 -60.9 -51.0 71.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.473 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.31 -50.03 69.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.774 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -60.25 -37.23 79.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.433 -177.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -60.46 -32.04 71.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 110.724 174.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 11.3 m -89.36 16.94 6.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.44 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' SER . 52.3 m-80 77.5 3.55 3.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.831 0.852 . . . . 0.0 111.741 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.536 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 7.3 m-20 -80.24 84.68 5.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 110.324 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.466 ' HD2' ' HG2' ' A' ' 33' ' ' LYS . 55.5 m80 -70.93 -43.24 68.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.972 178.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -63.75 -39.64 94.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.139 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.536 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 12.1 mt -60.11 -49.0 79.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.795 0.331 . . . . 0.0 110.823 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.649 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -64.54 -34.16 77.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.127 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -64.8 -44.64 89.27 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.723 0.297 . . . . 0.0 110.784 173.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . 0.51 ' O ' ' HA3' ' A' ' 95' ' ' GLY . . . -67.63 -21.26 65.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.909 -177.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.5 mt -83.3 -61.62 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.433 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.649 HG12 ' O ' ' A' ' 89' ' ' ALA . 7.9 mm -56.46 -62.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.517 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.616 ' OD1' ' HB3' ' A' ' 30' ' ' GLN . 3.5 m-20 -72.53 -14.59 61.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.358 -178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . 0.51 ' HA3' ' O ' ' A' ' 91' ' ' ALA . . . -74.13 -21.62 78.82 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.174 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -83.01 -55.62 4.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 110.647 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 4.5 t-20 156.31 -30.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -176.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.968 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -54.24 137.05 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 112.936 -1.938 . . . . 0.0 110.947 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 11.2 p -144.57 174.14 11.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.324 0.583 . . . . 0.0 112.175 -175.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.766 HD11 ' O ' ' A' ' 107' ' ' GLU . 82.8 mt -145.73 137.31 12.94 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.463 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.33 -6.94 13.91 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.312 1.341 . . . . 0.0 110.45 164.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -80.79 -59.65 2.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.893 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . 0.782 ' HA2' ' HG3' ' A' ' 30' ' ' GLN . . . 95.19 40.74 4.19 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.083 -1.055 . . . . 0.0 111.912 -172.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.401 ' H ' HD13 ' A' ' 100' ' ' LEU . . . -115.77 153.4 31.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.323 0.582 . . . . 0.0 111.476 -177.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.607 HD11 ' HA ' ' A' ' 78' ' ' ALA . 2.0 tm? -91.25 -16.44 27.6 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.4 p -91.91 9.68 31.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.947 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.766 ' O ' HD11 ' A' ' 100' ' ' LEU . 27.6 mt-10 -145.59 151.96 38.93 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.505 ' SG ' HD22 ' A' ' 74' ' ' LEU . 94.4 m -155.86 138.73 15.3 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -115.73 123.06 47.33 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.717 0.77 . . . . 0.0 110.09 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ASP . . . . . 0.968 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.8 t70 -91.75 152.67 20.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.247 -1.342 . . . . 0.0 110.307 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.5 -23.43 65.91 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.244 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.426 ' HB2' ' ND2' ' A' ' 114' ' ' ASN . 21.4 mt -78.83 1.83 22.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.959 0.409 . . . . 0.0 111.014 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.67 26.81 12.4 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.957 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 90.2 m-20 -101.98 155.27 18.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.888 -173.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -138.52 137.46 37.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.084 0.469 . . . . 0.0 110.609 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 13.0 m-85 -117.76 132.45 56.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.437 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 6.2 mm-40 -123.86 121.36 35.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 -176.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 33.9 tp -103.75 120.59 50.94 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -169.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.583 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 21.2 Cg_exo -71.38 156.42 58.64 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 123.869 3.046 . . . . 0.0 112.79 175.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.071 HG22 ' HE1' ' A' ' 39' ' ' TRP . 21.1 m -67.72 -18.75 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.896 -172.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.583 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 3.9 p90 -61.01 -18.13 56.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.843 0.354 . . . . 0.0 111.546 -170.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.9 t -103.44 -0.56 29.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.436 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -137.08 -54.35 0.7 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -175.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.483 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -135.11 119.34 13.4 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.517 -170.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 68.7 Cg_endo -101.48 21.64 0.19 Allowed 'Trans proline' 0 CA--C 1.558 1.69 0 C-N-CA 122.945 2.43 . . . . 0.0 117.002 178.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.483 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 41.9 Cg_endo -70.04 -34.49 13.56 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-N 122.339 1.871 . . . . 0.0 111.897 175.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.82 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.331 -0.236 0 CA-C-O 121.56 0.695 . . . . 0.0 110.852 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.684 ' O ' ' HB ' ' A' ' 99' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.155 0 CA-C-O 120.924 0.392 . . . . 0.0 111.385 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.601 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 30.8 p-10 -108.91 158.7 17.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 170.062 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -80.27 111.32 21.38 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -162.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.671 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 4.8 Cg_exo -79.71 -164.57 0.29 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.743 2.962 . . . . 0.0 109.972 166.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 28.4 tp -52.74 132.06 35.82 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 176.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.537 ' HE3' ' CZ ' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -57.25 109.53 0.68 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.361 0.6 . . . . 0.0 111.319 -175.656 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.877 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 10.8 mmpt? -97.55 -19.86 18.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.053 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.19 170.07 8.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.493 0.664 . . . . 0.0 111.605 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -109.38 159.85 29.87 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.04 -177.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.732 ' HB2' HG12 ' A' ' 120' ' ' VAL . 33.1 Cg_exo -51.29 128.73 26.39 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.567 2.178 . . . . 0.0 112.294 -175.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.486 ' HE2' ' HB3' ' A' ' 38' ' ' LYS . 24.3 ttpt -113.46 123.21 49.5 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.253 -170.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 1.02 ' HE1' HG22 ' A' ' 120' ' ' VAL . 3.1 p-90 -176.3 25.17 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.666 -1.152 . . . . 0.0 109.441 172.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HE2' HG21 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -157.59 166.02 34.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.979 -167.309 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 52.1 m -69.37 128.75 37.66 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 165.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -76.92 -18.31 58.37 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . 0.519 ' CE2' ' HG2' ' A' ' 45' ' ' MET . 51.2 t80 -133.34 75.0 71.05 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.215 170.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.513 ' O ' ' HB2' ' A' ' 49' ' ' GLN . 50.4 Cg_exo -62.45 -26.36 76.47 Favored 'Trans proline' 0 CA--C 1.508 -0.809 0 C-N-CA 123.853 3.035 . . . . 0.0 113.549 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.519 ' HG2' ' CE2' ' A' ' 43' ' ' TYR . 54.1 mtt 78.18 -82.64 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.696 -1.593 . . . . 0.0 110.797 -177.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 67.3 p -115.69 175.85 5.34 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.102 -177.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.604 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 0.8 OUTLIER -68.12 -36.7 80.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.432 0.158 . . . . 0.0 110.618 -177.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.08 -41.94 94.83 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.167 -0.54 . . . . 0.0 111.863 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.76 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -74.46 -38.49 62.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.516 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 59.8 tp -54.48 -54.34 42.28 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.299 0.375 . . . . 0.0 111.15 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 14.9 ptm180 -64.51 -47.1 80.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.323 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.1 t -60.64 -45.35 94.38 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.684 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.482 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 65.5 mmtt -72.72 -30.09 63.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.495 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -57.94 -41.32 82.54 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.55 -50.64 35.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.438 0.637 . . . . 0.0 110.745 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -54.91 -46.85 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.633 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.482 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 34.0 m-85 -70.48 -36.43 73.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.467 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -30.58 48.0 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.388 0.43 . . . . 0.0 111.223 176.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -60.62 -34.25 73.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 112.074 173.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 m -100.0 -27.1 13.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.977 -171.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.506 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -52.1 -52.93 57.48 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -175.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.506 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 49.4 Cg_endo . . . . . 0 C--N 1.348 0.525 0 C-N-CA 122.166 1.911 . . . . 0.0 112.877 -177.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.492 ' HA2' ' OD1' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.432 -1.609 0 N-CA-C 111.347 -0.701 . . . . 0.0 111.347 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.664 ' O ' HG22 ' A' ' 70' ' ' ILE . 33.7 mmt180 -66.51 94.72 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 171.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' A' ' 68' ' ' LYS . 15.1 tptm -50.85 -37.11 41.29 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.793 -171.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -58.41 -33.43 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.664 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -82.77 -22.52 8.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.229 -178.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.626 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -50.62 -37.2 38.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.808 -173.285 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -59.24 -34.24 71.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.326 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.22 -29.01 42.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.02 0.438 . . . . 0.0 110.091 -178.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.605 HD21 HD13 ' A' ' 70' ' ' ILE . 34.2 mt -67.96 -49.27 62.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.467 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.4 ptpt -69.01 -28.99 67.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.708 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.74 -38.72 76.92 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.179 176.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.402 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -67.95 -51.35 48.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.618 178.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -51.54 -34.13 35.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 172.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 28.5 t60 -64.18 -47.55 79.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.133 0.492 . . . . 0.0 109.81 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.46 ' HB1' ' HB2' ' A' ' 88' ' ' LEU . . . -68.85 -53.46 21.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.537 ' CZ ' ' HE3' ' A' ' 33' ' ' LYS . 12.7 t80 -54.44 -28.5 44.55 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.802 177.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -63.17 -28.82 70.32 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.591 -0.693 . . . . 0.0 111.229 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.7 t -92.15 15.26 13.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.469 0.652 . . . . 0.0 109.455 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 57.4 t30 70.71 7.44 6.22 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.012 -178.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.435 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 4.7 m-20 -73.84 82.05 1.64 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.199 0.524 . . . . 0.0 110.441 176.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 -72.09 -37.25 69.61 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.458 174.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 88' ' ' LEU . 10.2 pt-20 -53.67 -43.7 69.07 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.699 178.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.482 ' O ' HG13 ' A' ' 92' ' ' ILE . 14.5 mt -65.65 -51.93 55.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.981 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.573 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -63.27 -40.11 96.47 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.92 -176.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -66.17 -38.78 88.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.772 0.32 . . . . 0.0 110.195 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.55 -21.0 61.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.666 -179.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.3 mt -81.84 -60.68 2.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.861 177.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.573 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -52.66 -61.81 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.416 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.26 -25.25 65.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.564 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -75.24 -12.61 83.41 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.951 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -102.07 6.63 41.09 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.987 -0.126 . . . . 0.0 110.881 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.8 t30 74.14 8.11 4.69 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.982 0.896 . . . . 0.0 109.525 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.934 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -90.51 138.2 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.348 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.684 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 19.8 p -123.19 164.79 18.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.362 -177.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.851 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.6 tm? -150.42 104.11 3.11 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.483 178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.713 ' HD2' HD22 ' A' ' 100' ' ' LEU . 67.4 Cg_endo -71.62 -7.9 22.12 Favored 'Trans proline' 0 N--CA 1.476 0.475 0 C-N-CA 123.325 2.684 . . . . 0.0 114.216 -173.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.635 ' H ' HD13 ' A' ' 100' ' ' LEU . 29.7 m-70 -82.72 -15.45 51.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 177.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . 0.671 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 68.77 37.67 84.51 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.275 -176.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.851 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -135.36 152.76 51.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 121.267 0.556 . . . . 0.0 111.572 -175.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.476 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.6 tm? -79.55 -21.92 44.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.279 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 118' ' ' LEU . 37.7 p -87.7 24.09 1.81 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.242 -173.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.686 ' HB3' HD21 ' A' ' 100' ' ' LEU . 32.5 mt-10 -156.07 149.56 24.76 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.44 ' SG ' HD22 ' A' ' 74' ' ' LEU . 74.8 m -151.31 139.44 20.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.04 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.484 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 12.5 m-30 -118.72 121.59 40.46 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.89 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ASP . . . . . 0.934 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.0 OUTLIER -84.5 145.12 28.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.106 178.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -58.6 -31.81 68.4 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 124.649 1.218 . . . . 0.0 111.835 -171.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 16.8 mt -69.36 -40.5 77.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.568 -177.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 141.75 43.6 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.766 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.875 ' HB3' ' HB3' ' A' ' 110' ' ' ASP . 1.8 t-20 -109.14 152.49 25.04 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.287 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.484 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 38.6 ttp180 -134.73 128.03 32.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.785 0.326 . . . . 0.0 110.31 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -117.37 137.97 52.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.808 177.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -122.29 119.45 31.18 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.502 ' HB2' ' O ' ' A' ' 106' ' ' THR . 4.0 mm? -95.53 115.34 65.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -170.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.561 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 33.7 Cg_exo -69.21 155.2 68.46 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 124.169 3.246 . . . . 0.0 113.622 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.02 HG22 ' HE1' ' A' ' 39' ' ' TRP . 11.1 m -72.69 -23.02 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 114.75 -1.114 . . . . 0.0 112.631 -171.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.561 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.6 p90 -55.95 -29.69 60.55 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -168.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.6 t -99.32 -1.71 38.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.598 0.237 . . . . 0.0 111.34 -175.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.3 mt -133.85 -71.38 0.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.975 -174.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.701 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -118.76 116.06 34.83 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.606 -170.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 83.0 Cg_endo -104.16 32.61 0.06 OUTLIER 'Trans proline' 0 CA--C 1.556 1.582 0 C-N-CA 123.045 2.497 . . . . 0.0 116.539 177.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.73 -19.61 18.37 Favored 'Trans proline' 0 C--N 1.367 1.506 0 CA-C-N 121.945 1.73 . . . . 0.0 111.68 172.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.666 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.377 0 CA-C-O 121.471 0.653 . . . . 0.0 109.921 176.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.641 ' O ' ' HB ' ' A' ' 99' ' ' THR . 8.8 mtt180 . . . . . 0 CA--C 1.519 -0.217 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.564 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 8.7 p30 -109.67 161.51 15.32 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -176.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.606 ' HA ' ' HA2' ' A' ' 103' ' ' GLY . 26.2 tt0 -79.67 109.27 11.25 Favored Pre-proline 0 CA--C 1.534 0.331 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -165.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.939 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 73.2 Cg_endo -76.63 -165.29 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.335 2.69 . . . . 0.0 111.425 171.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.649 HD23 ' HE3' ' A' ' 34' ' ' LYS . 17.9 tp -48.33 138.06 10.38 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.189 0.518 . . . . 0.0 111.119 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.831 ' HG2' ' HB2' ' A' ' 105' ' ' LEU . 0.4 OUTLIER -76.9 94.15 3.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.874 -172.136 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.649 ' HE3' HD23 ' A' ' 32' ' ' LEU . 32.8 mmtp -98.68 -42.28 7.31 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.479 ' HG2' ' HZ3' ' A' ' 38' ' ' LYS . 9.4 tp10 -68.66 156.45 38.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.638 0.732 . . . . 0.0 112.543 -169.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.491 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 35.7 mmtm -95.08 160.93 29.82 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.251 -179.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.774 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 20.6 Cg_exo -66.44 138.37 50.2 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.239 1.959 . . . . 0.0 112.41 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.704 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 3.7 mtmt -110.76 148.98 31.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.847 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 1.029 ' HE1' HG22 ' A' ' 120' ' ' VAL . 0.8 OUTLIER 125.64 -4.52 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.105 0 O-C-N 126.047 2.092 . . . . 0.0 108.945 -171.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.543 ' HD2' ' O ' ' A' ' 41' ' ' SER . 0.0 OUTLIER -115.94 151.9 34.5 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.563 -167.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.543 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 58.4 m -64.98 149.08 50.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.456 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -56.81 -50.57 71.98 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -139.22 102.6 7.38 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.548 171.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.524 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 15.0 Cg_exo -67.88 131.63 24.53 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.077 1.851 . . . . 0.0 109.828 172.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.76 -81.3 0.33 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.742 -175.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 43.1 p -115.17 -175.52 2.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.894 178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -68.13 -36.53 79.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.788 0.328 . . . . 0.0 111.133 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.543 ' O ' ' HG2' ' A' ' 51' ' ' ARG . . . -63.07 -42.14 99.64 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.881 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -68.16 -37.7 81.3 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 1.4 tt -59.47 -55.33 35.97 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.029 178.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.543 ' HG2' ' O ' ' A' ' 48' ' ' GLY . 5.9 ptp180 -58.7 -46.99 86.07 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.754 0.311 . . . . 0.0 111.756 -176.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.47 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 74.2 m -67.35 -52.06 44.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.171 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -66.64 -32.67 74.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.242 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 54' ' ' ARG . 11.0 ttm180 -55.41 -48.29 74.6 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.22 -47.99 77.56 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.654 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 52' ' ' SER . 59.8 mt-10 -52.64 -48.47 66.39 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.762 177.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -66.1 -40.33 90.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.574 178.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.449 ' HA ' ' HB3' ' A' ' 61' ' ' ALA . 7.1 m95 -54.1 -31.36 51.81 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 177.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -66.96 -19.07 65.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.855 0.359 . . . . 0.0 111.27 176.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.8 m -108.27 -16.46 14.24 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.603 0.716 . . . . 0.0 110.224 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.844 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -76.88 169.61 20.34 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.303 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.844 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 36.0 Cg_endo . . . . . 0 C--N 1.346 0.439 0 C-N-CA 122.546 2.164 . . . . 0.0 113.069 -176.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.806 0 N-CA-C 112.722 -0.151 . . . . 0.0 112.722 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.614 ' HB2' HG22 ' A' ' 70' ' ' ILE . 5.3 mmp_? -143.36 126.62 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 122.72 0.408 . . . . 0.0 109.992 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -71.02 -26.82 63.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.084 0.469 . . . . 0.0 110.072 176.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.402 ' OE2' ' HD3' ' A' ' 67' ' ' ARG . 2.3 mp0 -60.53 -43.1 97.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.945 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.844 HD12 ' HB2' ' A' ' 110' ' ' ASP . 0.0 OUTLIER -80.8 -23.42 10.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.189 -176.637 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.558 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 2.0 m95 -52.5 -37.11 56.62 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -177.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -58.11 -35.36 71.33 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.278 0.361 . . . . 0.0 111.08 -177.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.25 -29.85 57.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.108 0.48 . . . . 0.0 110.555 -178.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.504 HD21 ' CD1' ' A' ' 70' ' ' ILE . 16.8 mt -67.72 -53.4 27.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.185 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.7 ptpt -65.13 -30.42 71.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.898 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.84 -36.97 76.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.103 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.08 -50.38 48.86 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.601 0.239 . . . . 0.0 110.438 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -31.92 61.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.419 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 24.5 t60 -63.78 -47.37 81.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 109.846 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -70.99 -52.37 20.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.827 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.568 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 21.0 t80 -57.28 -35.14 69.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.486 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.06 -27.13 68.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.943 0.401 . . . . 0.0 111.322 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -94.97 22.11 6.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.28 177.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.6 m120 77.02 0.96 3.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.648 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.777 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 2.0 m-20 -77.46 84.37 3.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.321 0.581 . . . . 0.0 110.705 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 33' ' ' LYS . 60.0 m80 -71.92 -39.68 69.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.947 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.529 ' HA ' ' NE2' ' A' ' 90' ' ' GLN . 11.5 pt-20 -69.82 -37.71 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.385 -177.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.777 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -62.99 -51.22 67.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.931 0.396 . . . . 0.0 110.768 -179.846 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.806 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -62.34 -46.43 88.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.576 -175.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.529 ' NE2' ' HA ' ' A' ' 87' ' ' GLU . 10.7 pt20 -63.79 -34.46 77.96 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.59 0.233 . . . . 0.0 110.528 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.17 -26.61 62.15 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.918 0.39 . . . . 0.0 110.557 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.8 mt -72.01 -47.06 56.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 174.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.649 HG23 HG22 ' A' ' 98' ' ' ILE . 9.7 mm -49.8 -61.83 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.529 173.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.166 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.56 -23.9 70.71 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.44 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 98' ' ' ILE . . . -99.97 9.27 43.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.154 -178.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 62.6 t30 69.85 11.93 7.85 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.83 1.3 . . . . 0.0 108.882 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.649 HG22 HG23 ' A' ' 93' ' ' ILE . 51.2 mt -83.88 141.0 15.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 113.343 -1.753 . . . . 0.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.641 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 30.0 p -134.5 168.6 18.66 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.101 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.536 HD21 ' C ' ' A' ' 107' ' ' GLU . 4.0 mt -150.2 106.5 3.17 Favored Pre-proline 0 N--CA 1.449 -0.506 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.05 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.525 ' HD2' ' CD2' ' A' ' 109' ' ' TYR . 24.9 Cg_endo -63.14 -26.36 72.89 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 121.431 1.421 . . . . 0.0 110.574 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -77.23 -20.89 54.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.798 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . 0.939 ' HA3' ' HD2' ' A' ' 31' ' ' PRO . . . 55.96 38.26 74.27 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 114.819 -1.082 . . . . 0.0 114.18 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.434 ' O ' HD13 ' A' ' 100' ' ' LEU . . . -110.93 149.21 30.97 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.756 0.313 . . . . 0.0 110.978 -177.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.831 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.84 -24.41 44.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.774 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 47.4 p -85.21 26.82 0.85 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.583 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.536 ' C ' HD21 ' A' ' 100' ' ' LEU . 20.1 mt-10 -165.48 156.98 14.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.261 175.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.507 ' HA ' HD21 ' A' ' 100' ' ' LEU . 86.9 m -156.22 139.86 15.99 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 172.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.525 ' CD2' ' HD2' ' A' ' 101' ' ' PRO . 18.3 m-30 -116.87 121.98 43.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.972 0.891 . . . . 0.0 110.266 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ASP . . . . . 0.879 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 3.5 t70 -80.48 149.07 30.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.249 -177.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -59.66 -25.97 65.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.933 -1.03 . . . . 0.0 112.714 -168.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -74.8 -9.6 58.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.208 0.528 . . . . 0.0 110.642 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.16 26.04 6.17 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.95 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.879 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 64.5 m-80 -94.73 150.24 20.41 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.425 ' HA ' ' HD1' ' A' ' 109' ' ' TYR . 10.3 ptp180 -123.37 144.69 49.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.045 0.45 . . . . 0.0 109.881 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -136.01 142.45 44.47 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.155 174.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.506 ' HA ' ' HG2' ' A' ' 107' ' ' GLU . 45.7 mt-30 -122.31 119.9 32.49 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 0.2 OUTLIER -85.67 112.5 45.13 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.45 -171.658 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.556 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 37.0 Cg_exo -69.16 154.71 69.68 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.586 2.857 . . . . 0.0 113.404 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.029 HG22 ' HE1' ' A' ' 39' ' ' TRP . 32.6 m -61.52 -16.82 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.94 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.556 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.7 p90 -59.24 -21.02 58.91 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -169.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 20.6 t -126.88 14.44 7.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.013 0.435 . . . . 0.0 110.688 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.706 HD13 HG22 ' A' ' 106' ' ' THR . 65.7 mt -132.54 -53.04 0.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.949 0.404 . . . . 0.0 111.902 -176.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.582 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -128.05 114.88 20.33 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-O 120.712 0.291 . . . . 0.0 110.953 -173.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.434 ' N ' ' CD ' ' A' ' 126' ' ' PRO . 75.6 Cg_endo -96.99 16.21 0.7 Allowed 'Trans proline' 0 CA--C 1.558 1.719 0 C-N-CA 123.012 2.475 . . . . 0.0 117.162 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.582 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 39.9 Cg_endo -68.66 -16.32 42.13 Favored 'Trans proline' 0 C--N 1.371 1.742 0 CA-C-N 122.486 1.924 . . . . 0.0 111.656 173.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.633 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.202 177.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.687 HH11 ' HB3' ' A' ' 29' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.225 0 CA-C-O 121.426 0.631 . . . . 0.0 110.401 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.687 ' HB3' HH11 ' A' ' 28' ' ' ARG . 4.9 p-10 -97.28 160.33 14.39 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.753 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -81.37 106.29 5.57 Favored Pre-proline 0 C--N 1.326 -0.431 0 O-C-N 123.589 0.555 . . . . 0.0 112.36 -169.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.704 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 91.4 Cg_endo -79.59 -164.99 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 123.284 2.656 . . . . 0.0 111.222 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.2 mp -50.58 137.65 19.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.785 0.326 . . . . 0.0 110.757 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.721 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -75.43 100.62 4.53 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.375 1.083 . . . . 0.0 111.201 -171.007 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -98.4 -19.14 17.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.228 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.774 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 4.0 tp10 -95.67 149.26 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.091 0.472 . . . . 0.0 110.751 -174.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -98.73 161.47 24.91 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.617 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.662 ' HG3' HG21 ' A' ' 106' ' ' THR . 32.0 Cg_exo -55.58 142.23 81.98 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.617 2.211 . . . . 0.0 112.995 -177.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.644 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 36.2 ttpt -111.54 135.69 51.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.384 -170.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 1.043 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.4 p-90 152.01 -17.25 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.792 1.307 . . . . 0.0 110.961 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.474 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.41 164.51 13.51 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.573 0.225 . . . . 0.0 110.881 -174.664 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 39.7 m -65.27 119.73 11.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.839 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -67.5 -28.76 68.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -126.18 89.77 51.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.369 167.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.16 137.12 13.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.973 2.449 . . . . 0.0 112.262 177.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.42 ' HB3' ' H ' ' A' ' 46' ' ' THR . 12.4 mmm -108.03 -137.64 0.37 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 174.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.42 ' H ' ' HB3' ' A' ' 45' ' ' MET . 47.5 p -81.03 -175.19 5.28 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.783 -177.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.488 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 21.0 t70 -56.69 -49.58 74.69 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -168.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.07 -36.14 91.85 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.706 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -72.37 -44.17 62.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 0.0 110.263 175.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.458 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 50.6 tp -60.3 -45.52 93.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.807 -178.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 12.4 ptp180 -64.68 -50.84 65.42 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.463 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 26.7 t -64.07 -57.38 9.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.693 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 57' ' ' PHE . 2.0 tppt? -63.99 -28.05 69.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.138 -174.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 40.5 ttm180 -58.1 -45.65 86.86 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 172.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.2 -49.32 61.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 2.0 mp0 -50.36 -47.36 56.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.541 0.686 . . . . 0.0 110.495 174.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -69.4 -38.81 78.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.832 -179.246 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.483 ' CE3' ' HB3' ' A' ' 61' ' ' ALA . 2.3 m95 -53.2 -29.48 32.24 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.435 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 9.4 t70 -58.15 -27.16 63.54 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.492 0.663 . . . . 0.0 110.767 172.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.9 m -105.59 13.16 30.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.542 0.687 . . . . 0.0 110.096 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 1.003 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -99.33 175.81 2.26 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 1.003 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 31.6 Cg_endo . . . . . 0 C--N 1.365 1.419 0 C-N-CA 124.657 3.571 . . . . 0.0 116.001 -170.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.582 0 N-CA-C 111.555 -0.618 . . . . 0.0 111.555 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.682 ' O ' HG22 ' A' ' 70' ' ' ILE . 4.0 mmp_? -108.74 96.13 6.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 110.54 -0.17 . . . . 0.0 110.54 177.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.545 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 16.7 tptm -45.74 -35.09 4.03 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.222 0.609 . . . . 0.0 111.726 178.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.447 ' H ' ' HG3' ' A' ' 69' ' ' GLU . 20.5 mt-10 -50.57 -40.25 51.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.12 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.682 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.9 OUTLIER -82.83 -22.1 9.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -175.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.545 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.09 -40.18 14.7 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 122.866 0.467 . . . . 0.0 111.881 -171.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.91 -36.84 70.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.581 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.61 -26.04 45.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.159 0.504 . . . . 0.0 110.296 -176.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.587 HD21 HD13 ' A' ' 70' ' ' ILE . 51.4 mt -70.29 -46.31 64.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.611 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 0.4 OUTLIER -72.71 -25.85 61.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.716 177.179 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -68.26 -39.67 82.14 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.726 0.298 . . . . 0.0 110.702 174.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -65.8 -47.35 75.4 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.483 176.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.674 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -49.96 -39.65 41.33 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.597 171.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 22.3 t60 -62.33 -47.69 83.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.224 -178.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -65.12 -53.95 37.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 177.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.599 ' HE1' ' HE3' ' A' ' 33' ' ' LYS . 9.6 t80 -53.94 -30.51 46.84 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.423 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.674 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.0 mt-10 -56.64 -40.66 75.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 175.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -84.96 20.34 1.88 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.463 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.7 t30 71.59 9.65 6.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.217 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.629 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 2.5 t0 -80.79 83.77 6.47 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.489 0.661 . . . . 0.0 110.536 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -72.56 -41.55 65.61 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.094 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.08 -43.8 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.286 -176.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.483 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.0 mt -55.58 -52.79 62.57 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 120.802 0.334 . . . . 0.0 110.771 175.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.632 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -61.74 -47.3 85.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.792 -176.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -27.67 65.71 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.61 -177.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -74.76 -32.56 62.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.846 0.355 . . . . 0.0 110.254 176.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.3 mt -68.76 -57.2 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.349 176.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -51.03 -61.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.208 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.41 ' HA ' ' O ' ' A' ' 98' ' ' ILE . 21.1 t70 -71.33 -18.25 62.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.252 -174.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.96 -11.52 70.02 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.121 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -108.93 8.68 26.52 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.097 -0.061 . . . . 0.0 111.029 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.1 m-80 72.95 4.34 4.94 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.313 0.578 . . . . 0.0 110.392 -173.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 1.101 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -83.73 134.88 25.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.736 172.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 21.3 p -138.97 166.36 24.69 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.772 -177.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.87 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.4 tm? -148.12 104.34 3.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.743 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.527 ' HD2' HD22 ' A' ' 100' ' ' LEU . 32.1 Cg_endo -63.81 -30.54 68.5 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.195 2.597 . . . . 0.0 113.779 -173.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -68.29 -9.55 48.45 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.67 0.272 . . . . 0.0 111.671 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . 0.721 ' O ' ' HA ' ' A' ' 33' ' ' LYS . . . 73.49 18.29 79.34 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.328 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.87 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -95.01 140.31 30.15 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.511 0.672 . . . . 0.0 111.373 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.652 HD11 ' HA ' ' A' ' 78' ' ' ALA . 2.5 tm? -83.15 -16.34 47.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.184 175.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.662 HG21 ' HG3' ' A' ' 37' ' ' PRO . 59.8 p -91.07 14.99 12.51 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.05 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 28.9 mt-10 -149.84 144.71 26.14 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 78.9 m -150.86 138.33 19.56 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 175.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.434 ' CD1' ' HG2' ' A' ' 115' ' ' ARG . 16.3 m-30 -116.93 122.5 44.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.511 0.672 . . . . 0.0 109.533 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ASP . . . . . 1.101 ' HA ' HG13 ' A' ' 98' ' ' ILE . 2.6 t70 -81.38 148.29 29.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.021 -173.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -55.26 -27.74 48.56 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 124.551 1.157 . . . . 0.0 112.645 -171.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.4 mt -78.95 -7.37 57.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.944 0.402 . . . . 0.0 110.874 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 23.44 7.27 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.182 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.994 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 59.1 m-80 -92.58 161.63 14.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.779 0.323 . . . . 0.0 110.904 -176.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.434 ' HG2' ' CD1' ' A' ' 109' ' ' TYR . 78.0 mtt180 -129.82 128.13 41.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.07 0.462 . . . . 0.0 111.187 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . 0.589 ' HE1' ' H ' ' A' ' 67' ' ' ARG . 20.2 m-85 -117.98 124.06 47.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.715 171.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -123.88 121.14 34.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.048 -171.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.59 HD23 HG22 ' A' ' 106' ' ' THR . 38.0 tp -98.99 119.82 59.96 Favored Pre-proline 0 C--N 1.319 -0.757 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -170.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.627 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 24.5 Cg_exo -69.38 156.2 65.03 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.313 2.675 . . . . 0.0 112.739 174.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.043 HG22 ' HE1' ' A' ' 39' ' ' TRP . 33.7 m -66.81 -15.79 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.273 -175.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.627 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.3 p90 -58.67 -21.65 54.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.944 0.402 . . . . 0.0 111.865 -172.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 37.0 t -101.61 2.4 38.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.179 -175.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 61.9 mt -139.6 -52.05 0.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.455 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -137.37 114.37 9.67 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.991 -173.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 88.5 Cg_endo -103.3 27.19 0.1 OUTLIER 'Trans proline' 0 CA--C 1.555 1.556 0 C-N-CA 122.973 2.448 . . . . 0.0 117.043 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.524 ' HD2' HD13 ' A' ' 127' ' ' ILE . 80.7 Cg_endo -81.35 -19.04 8.09 Favored 'Trans proline' 0 C--N 1.365 1.428 0 CA-C-N 122.268 1.846 . . . . 0.0 112.205 173.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.773 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.424 0 CA-C-O 121.257 0.551 . . . . 0.0 110.442 178.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.751 ' O ' ' HB ' ' A' ' 99' ' ' THR . 22.1 mmm180 . . . . . 0 N--CA 1.446 -0.669 0 CA-C-O 121.081 0.467 . . . . 0.0 110.996 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.415 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 28.0 p-10 -90.11 156.38 18.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.337 -174.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.692 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 9.0 pt20 -90.46 117.26 67.87 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -169.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.615 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.0 Cg_exo -70.18 -163.59 0.12 Allowed 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.959 3.106 . . . . 0.0 112.172 170.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.25 139.01 15.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.857 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.925 ' HZ2' ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -107.47 104.98 14.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.713 -170.057 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.579 ' HD3' ' O ' ' A' ' 34' ' ' LYS . 11.8 tmtt? -99.14 -24.12 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.51 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.611 ' OE1' ' HB3' ' A' ' 102' ' ' HIS . 44.3 mt-10 -71.39 167.4 19.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.524 0.678 . . . . 0.0 112.226 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.466 ' N ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -105.86 152.9 40.34 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.328 -166.22 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.76 ' HG3' HG21 ' A' ' 106' ' ' THR . 24.8 Cg_exo -62.01 144.88 96.74 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.021 2.481 . . . . 0.0 111.913 177.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.508 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 18.3 ttpp -112.22 115.88 29.53 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -168.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 1.008 ' HE1' HG12 ' A' ' 120' ' ' VAL . 1.1 p-90 170.71 20.84 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 113.2 -1.818 . . . . 0.0 109.966 173.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.567 ' HD2' ' O ' ' A' ' 41' ' ' SER . 1.6 tmmt? -128.34 147.97 50.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.04 0.448 . . . . 0.0 110.733 -159.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.567 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 58.2 m -64.62 140.31 58.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.571 -175.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.97 -39.36 74.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.678 175.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -140.99 92.22 8.68 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.053 171.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.553 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 7.4 Cg_exo -72.42 134.58 22.85 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.477 2.118 . . . . 0.0 110.502 175.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.1 ttp -112.66 -86.12 0.57 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.254 -175.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 46.4 p -117.67 -173.81 2.5 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.468 ' OD2' ' HD2' ' A' ' 51' ' ' ARG . 16.5 t70 -49.44 -44.87 45.87 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.866 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -53.19 -42.79 63.22 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.286 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 14.0 mm100 -72.23 -41.96 66.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.722 0.296 . . . . 0.0 110.333 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.75 -57.37 13.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.159 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.468 ' HD2' ' OD2' ' A' ' 47' ' ' ASP . 12.0 ptm180 -63.64 -45.52 89.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.494 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 31.1 t -65.41 -53.79 37.97 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.846 -176.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -65.77 -35.22 80.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.963 -179.363 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.44 ' HG3' ' CZ3' ' A' ' 39' ' ' TRP . 59.5 ttp180 -56.07 -46.5 78.96 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.435 0.159 . . . . 0.0 110.928 178.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.11 -52.7 46.22 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 120.998 0.428 . . . . 0.0 110.678 -177.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -55.76 -49.7 72.4 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.17 -45.27 81.51 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.564 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.423 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -50.14 -36.62 30.73 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.286 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -54.94 -41.02 70.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.724 0.297 . . . . 0.0 111.542 175.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -113.08 10.59 18.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.187 0.518 . . . . 0.0 111.376 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.751 ' O ' ' HB2' ' A' ' 117' ' ' GLN . . . -66.55 -60.18 6.97 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-O 119.085 -0.484 . . . . 0.0 111.047 -177.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.728 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 95.9 Cg_endo . . . . . 0 C--N 1.352 0.75 0 C-N-CA 121.876 1.717 . . . . 0.0 111.712 176.362 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.761 0 N-CA-C 113.824 0.289 . . . . 0.0 113.824 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.616 ' HD3' ' OD2' ' A' ' 110' ' ' ASP . 7.8 ttt180 -99.5 113.81 26.41 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 122.894 0.478 . . . . 0.0 109.758 -173.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.456 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 72.9 mmtt -75.64 -26.65 57.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -58.09 -37.16 73.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.168 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.682 HD12 HG12 ' A' ' 98' ' ' ILE . 0.8 OUTLIER -82.97 -22.01 8.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.553 -179.41 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.56 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -47.28 -41.73 19.44 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -172.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.566 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 11.9 m-20 -56.44 -31.29 63.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.08 -33.13 50.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.024 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.523 HD21 HD13 ' A' ' 70' ' ' ILE . 26.3 mt -70.55 -45.45 65.42 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.527 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 14.1 ptpt -68.9 -33.08 73.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.776 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -67.32 -36.05 80.67 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.954 0.407 . . . . 0.0 110.659 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.501 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -69.92 -48.99 56.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.708 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -52.6 -33.96 48.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.503 173.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.413 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 29.5 t60 -65.95 -51.36 59.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.509 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.14 -46.7 82.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.676 177.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -59.43 -33.61 71.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.241 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.46 -38.44 84.21 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.304 0.573 . . . . 0.0 110.823 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 22.7 t -85.72 21.31 1.9 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.322 -177.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 83' ' ' SER . 16.5 m120 73.82 0.43 3.63 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.838 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.653 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 14.8 m-20 -79.07 83.31 5.16 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.687 0.756 . . . . 0.0 110.314 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 58.6 m80 -71.9 -40.59 68.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.28 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.708 ' HA ' HE21 ' A' ' 90' ' ' GLN . 5.3 pt-20 -74.46 -31.52 62.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.26 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.653 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 10.1 mt -58.87 -51.55 69.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.174 0.511 . . . . 0.0 110.204 173.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.551 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -62.41 -44.23 96.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.001 -175.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.708 HE21 ' HA ' ' A' ' 87' ' ' GLU . 26.2 pt20 -66.88 -33.31 75.32 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.729 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.23 -26.24 61.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.855 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 88' ' ' LEU . 51.1 mt -74.15 -55.12 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 177.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.8 mm -52.18 -59.18 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.551 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.86 -27.26 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.709 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.78 -20.52 66.43 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.531 -0.758 . . . . 0.0 113.098 -177.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.542 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -84.48 -53.22 5.58 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.136 0.468 . . . . 0.0 110.21 179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.542 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.4 t-20 152.29 -28.29 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -175.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 1.015 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -57.66 145.38 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 112.44 -2.163 . . . . 0.0 111.734 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.751 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 33.7 p -132.74 165.47 24.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.568 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.845 HD22 ' HD2' ' A' ' 101' ' ' PRO . 2.3 tm? -150.84 113.51 3.16 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 173.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.845 ' HD2' HD22 ' A' ' 100' ' ' LEU . 13.2 Cg_endo -55.68 -42.14 70.47 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 124.012 3.141 . . . . 0.0 114.759 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.611 ' HB3' ' OE1' ' A' ' 35' ' ' GLU . 5.4 m-70 -72.66 -21.25 61.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -176.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . 0.615 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 86.15 17.12 61.55 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.933 -173.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.677 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -93.6 143.56 26.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.064 0.459 . . . . 0.0 110.971 -175.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.705 ' HB2' ' HG3' ' A' ' 33' ' ' LYS . 3.0 tm? -78.49 -32.03 48.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.779 -178.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.76 HG21 ' HG3' ' A' ' 37' ' ' PRO . 53.3 p -84.47 16.83 2.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.549 -172.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.603 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 41.1 mt-10 -148.5 140.95 24.28 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 76.8 m -152.19 145.14 24.45 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -118.67 122.8 43.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ASP . . . . . 1.015 ' HA ' HG13 ' A' ' 98' ' ' ILE . 12.6 t70 -80.92 148.41 29.87 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.236 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -57.5 -24.31 55.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.797 -1.092 . . . . 0.0 112.331 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.419 HD12 ' HD2' ' A' ' 67' ' ' ARG . 27.7 mt -79.23 -5.07 53.5 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.928 0.394 . . . . 0.0 110.949 -178.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.43 29.85 6.49 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.154 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.772 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 17.1 m120 -101.52 158.23 16.23 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.91 -0.171 . . . . 0.0 110.764 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -129.45 129.71 44.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.368 0.604 . . . . 0.0 110.762 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . 0.516 ' HE1' ' H ' ' A' ' 67' ' ' ARG . 17.3 m-85 -117.71 128.44 54.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.869 177.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.751 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 3.8 mm100 -123.21 127.23 48.33 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.511 HD23 HG22 ' A' ' 106' ' ' THR . 36.1 tp -98.75 124.24 46.73 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.385 -171.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.652 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 12.3 Cg_exo -72.82 155.04 53.93 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.33 2.687 . . . . 0.0 112.777 177.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.008 HG12 ' HE1' ' A' ' 39' ' ' TRP . 0.3 OUTLIER -76.45 -20.38 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 114.901 -1.045 . . . . 0.0 112.515 -171.244 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.652 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -57.08 -30.09 64.03 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.147 -171.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 46.9 t -94.51 -6.53 43.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.302 -173.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.495 HD12 ' HG3' ' A' ' 37' ' ' PRO . 94.6 mt -118.63 -54.12 2.28 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -175.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.432 ' HB3' HG22 ' A' ' 120' ' ' VAL . . . -117.67 111.75 39.33 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.154 0.502 . . . . 0.0 111.929 -172.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.37 -39.53 45.94 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 123.745 2.964 . . . . 0.0 115.862 176.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -42.69 -59.12 1.04 Allowed 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.658 2.239 . . . . 0.0 114.507 -175.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.844 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.436 0 CA-C-O 120.894 0.378 . . . . 0.0 111.746 -176.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.593 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.0 ppt_? . . . . . 0 N--CA 1.455 -0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.238 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.715 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -93.39 156.73 16.61 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 171.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.425 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.9 OUTLIER -81.12 104.21 2.64 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -158.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.935 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 92.5 Cg_endo -78.87 -162.46 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 123.733 2.955 . . . . 0.0 111.839 172.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.561 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.1 mp -49.01 144.68 4.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.308 0.575 . . . . 0.0 112.044 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.547 ' HD2' ' N ' ' A' ' 33' ' ' LYS . 8.6 mptt -84.85 83.29 8.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.313 -178.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -97.68 -18.33 18.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.936 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.924 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 9.2 tp10 -87.16 159.73 18.77 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.223 0.535 . . . . 0.0 110.451 -177.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.48 ' HG2' ' OE2' ' A' ' 35' ' ' GLU . 16.6 pttm -99.99 155.13 36.79 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.109 -173.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.635 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 5.1 Cg_exo -73.97 143.28 32.57 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.302 2.001 . . . . 0.0 111.514 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.737 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 23.5 ttpp -110.88 145.69 37.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.225 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 1.103 ' HE1' HG22 ' A' ' 120' ' ' VAL . 0.9 OUTLIER 134.43 -3.68 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 O-C-N 125.227 1.579 . . . . 0.0 109.844 -172.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -113.48 158.73 20.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -167.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.448 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 25.0 m -65.23 125.26 24.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.524 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -61.91 -26.35 68.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.407 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -146.0 88.95 6.19 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.395 173.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . 0.448 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 6.4 Cg_exo -75.4 137.34 20.72 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.924 2.416 . . . . 0.0 111.273 176.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 64.1 mtm -114.66 -75.39 0.59 Allowed 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -177.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 78.3 p -115.54 175.68 5.41 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.474 -0.491 . . . . 0.0 111.323 -178.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.01 -41.89 97.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.015 0.436 . . . . 0.0 110.077 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.81 -44.3 87.07 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.697 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -68.67 -45.07 72.69 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -54.92 -47.47 74.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.797 -177.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.0 ptm180 -73.42 -39.44 65.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.604 0.24 . . . . 0.0 111.477 -176.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 m -68.82 -42.18 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 60.1 mmtt -71.58 -32.57 68.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.055 177.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -53.2 -48.46 68.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.088 0.471 . . . . 0.0 110.041 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.35 -52.58 64.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.99 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.79 -49.34 75.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.722 -1.127 . . . . 0.0 111.734 -177.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.404 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 42.6 m-85 -70.36 -37.16 74.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.744 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.18 -37.56 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 177.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -66.74 -20.29 65.93 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.826 0.346 . . . . 0.0 111.784 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 15.4 m -95.08 -11.87 27.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 109.659 178.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.465 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -86.0 158.23 56.12 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.424 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.465 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 19.3 Cg_endo . . . . . 0 C--N 1.346 0.435 0 C-N-CA 123.016 2.478 . . . . 0.0 113.749 -170.454 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.433 ' HA2' ' CE1' ' A' ' 116' ' ' TYR . . . . . . . . 0 N--CA 1.443 -0.835 0 N-CA-C 111.922 -0.471 . . . . 0.0 111.922 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.679 ' O ' HG22 ' A' ' 70' ' ' ILE . 2.7 mmp_? -63.66 80.89 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 171.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.495 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 13.5 tptm -49.62 -37.82 29.5 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.897 0.479 . . . . 0.0 112.119 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.41 -40.74 62.51 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.186 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.679 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -84.32 -23.81 7.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.9 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.639 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -53.0 -38.49 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.259 -173.316 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.583 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 18.4 m-20 -62.49 -28.67 69.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.25 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.95 -27.58 39.75 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.519 0.676 . . . . 0.0 109.551 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.662 HD13 ' SG ' ' A' ' 108' ' ' CYS . 27.7 mt -74.71 -43.55 54.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.527 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.1 ptpt -70.53 -29.83 66.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.61 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.97 -38.29 72.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.767 175.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.64 -44.24 87.03 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.514 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -48.45 -41.14 28.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.694 170.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 29.7 t60 -62.26 -48.94 77.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.329 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -62.5 -53.03 60.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.622 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.522 ' HD2' HD22 ' A' ' 123' ' ' LEU . 20.6 t80 -55.47 -39.34 70.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.526 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.513 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.3 mt-10 -61.1 -33.75 73.87 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 8.1 t -87.57 20.11 3.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.159 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 83' ' ' SER . 3.4 m-20 73.44 4.8 4.89 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.751 0.82 . . . . 0.0 111.599 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.857 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 54.0 m-20 -82.35 84.1 7.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.825 0.821 . . . . 0.0 110.966 -179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.561 ' NE2' ' HA ' ' A' ' 32' ' ' LEU . 8.0 t-80 -69.03 -42.3 76.56 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.113 177.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.33 -33.75 71.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.146 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.857 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 7.0 mp -65.32 -56.32 13.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.975 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.616 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.67 -41.11 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.508 -176.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -69.35 -30.35 68.36 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.018 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.63 -21.99 51.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.938 0.399 . . . . 0.0 110.762 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 52.9 mt -77.93 -56.84 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.538 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 89' ' ' ALA . 10.1 mm -50.52 -60.67 0.79 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.122 176.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.02 -24.96 66.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.1 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.38 -16.74 73.78 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.859 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -97.99 5.59 48.64 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 122.718 -0.284 . . . . 0.0 110.893 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.6 t30 78.14 0.65 2.71 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.724 0.773 . . . . 0.0 109.76 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.943 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -89.71 144.92 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.426 177.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.593 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 22.7 p -140.62 171.1 14.58 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.456 -177.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.754 HD12 ' H ' ' A' ' 104' ' ' ALA . 1.6 tm? -148.59 103.36 3.46 Favored Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.13 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.525 ' HD2' HD22 ' A' ' 100' ' ' LEU . 21.2 Cg_endo -60.7 -25.13 80.38 Favored 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.763 2.975 . . . . 0.0 114.094 -174.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.556 ' H ' HD13 ' A' ' 100' ' ' LEU . 90.8 m-70 -76.26 -13.08 60.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.889 0.375 . . . . 0.0 110.402 177.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . 0.935 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 77.32 9.18 86.97 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.652 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.924 ' HB2' ' HB3' ' A' ' 35' ' ' GLU . . . -94.47 142.82 26.99 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.65 0.738 . . . . 0.0 111.612 -174.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.537 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.5 tm? -78.64 -14.23 59.42 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.225 -1.352 . . . . 0.0 107.792 173.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.635 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 25.4 p -84.24 6.85 21.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.153 -175.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -145.06 161.1 40.27 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.692 ' SG ' ' HB2' ' A' ' 116' ' ' TYR . 3.9 p -155.53 133.03 11.06 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.79 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.503 ' HA ' ' O ' ' A' ' 114' ' ' ASN . 19.4 m-30 -118.75 121.32 39.81 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.568 0.699 . . . . 0.0 109.573 177.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ASP . . . . . 0.943 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -87.29 152.27 22.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.773 -174.334 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.07 -25.47 63.79 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.854 -1.067 . . . . 0.0 112.645 -169.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.9 mt -79.05 -11.53 60.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.553 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.72 31.19 3.75 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.057 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.902 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 43.7 m-80 -96.11 145.09 25.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.689 0.281 . . . . 0.0 111.179 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.477 ' HA ' ' HD1' ' A' ' 109' ' ' TYR . 18.6 ptt180 -123.94 128.4 49.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.647 175.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . 0.692 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 35.3 m-85 -128.25 148.04 50.62 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 176.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 62' ' ' PRO . 9.3 mm100 -121.3 120.89 36.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.425 -173.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.723 HD12 ' HD2' ' A' ' 119' ' ' PRO . 13.9 tp -96.57 117.07 66.33 Favored Pre-proline 0 C--N 1.316 -0.868 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.584 -172.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.764 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 35.1 Cg_exo -62.51 154.99 60.87 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.821 3.014 . . . . 0.0 113.744 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.103 HG22 ' HE1' ' A' ' 39' ' ' TRP . 3.7 m -68.84 -16.49 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.223 -174.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.764 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.1 p90 -61.26 -18.28 57.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -169.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.5 t -121.06 14.54 11.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.059 -176.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.605 ' CD1' HG22 ' A' ' 106' ' ' THR . 95.8 mt -140.77 -52.22 0.47 Allowed 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.898 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.527 ' HB3' ' HB ' ' A' ' 120' ' ' VAL . . . -109.85 156.45 39.85 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.621 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.566 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 74.1 Cg_exo -53.3 -168.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.269 0 C-N-CA 123.618 2.879 . . . . 0.0 112.158 170.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.566 ' HD2' ' HB3' ' A' ' 125' ' ' PRO . 82.8 Cg_endo -69.74 13.51 0.28 Allowed 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.041 1.827 . . . . 0.0 112.654 -178.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.438 ' H ' ' C ' ' A' ' 125' ' ' PRO . 42.5 mm . . . . . 0 N--CA 1.455 -0.191 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.701 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.9 mmt85 . . . . . 0 CA--C 1.517 -0.303 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.617 ' HB2' ' OD2' ' A' ' 94' ' ' ASP . 3.3 p-10 -89.87 156.84 18.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.498 -175.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -84.52 109.76 22.22 Favored Pre-proline 0 C--N 1.325 -0.5 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -166.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.776 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 88.1 Cg_endo -79.1 -164.92 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.702 2.935 . . . . 0.0 111.467 169.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.04 149.24 19.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.385 0.612 . . . . 0.0 112.114 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.635 ' HE2' ' N ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -75.69 102.52 5.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.047 -172.436 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -97.29 -20.87 17.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.475 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.676 ' HB2' ' HB2' ' A' ' 104' ' ' ALA . 47.1 mt-10 -103.28 171.86 7.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.03 0.919 . . . . 0.0 113.266 -172.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.608 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 26.7 pttt -106.84 160.29 26.83 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 113.27 -1.786 . . . . 0.0 109.409 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.856 ' HG2' HG12 ' A' ' 120' ' ' VAL . 10.6 Cg_endo -61.58 139.29 80.63 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.266 1.977 . . . . 0.0 112.557 172.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.654 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 2.7 mtmt -112.14 147.81 35.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.198 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.99 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.9 p-90 132.27 -16.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.616 1.967 . . . . 0.0 108.289 -175.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.642 ' HG2' HG13 ' A' ' 127' ' ' ILE . 10.1 tppt? -113.45 153.69 28.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.365 -174.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 48.9 m -65.49 135.02 54.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.265 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -72.08 -27.34 62.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.69 175.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -131.78 81.99 61.67 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.108 170.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.43 130.11 16.83 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.603 2.202 . . . . 0.0 111.053 177.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.538 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.0 mtp -102.1 -87.64 0.4 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -174.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 69.1 p -118.78 179.09 4.24 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.365 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.517 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.7 t70 -54.66 -48.04 72.82 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.16 -35.15 82.98 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.232 -0.508 . . . . 0.0 112.608 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.695 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 31.3 mm-40 -70.13 -51.55 30.61 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 175.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.94 -47.97 76.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.808 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.649 ' HG3' ' N ' ' A' ' 52' ' ' SER . 13.6 ptp180 -62.9 -48.94 76.78 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.235 0.334 . . . . 0.0 111.586 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.649 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 24.3 t -68.46 -47.2 67.75 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -176.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.695 ' HB2' ' O ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -55.11 -44.45 74.99 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.512 173.897 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 62.0 ttt180 -60.77 -53.04 62.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.305 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.05 -49.93 74.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.77 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -51.97 -49.49 63.13 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.364 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.619 ' CD1' ' HA ' ' A' ' 39' ' ' TRP . 3.6 t80 -75.25 -38.91 60.3 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.581 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.504 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -53.99 -33.47 57.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.755 0.312 . . . . 0.0 111.338 -179.727 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.48 -25.85 68.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 0.0 111.566 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -109.13 -30.45 8.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.807 -172.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.654 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -49.49 -56.92 13.7 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -174.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 43.5 Cg_endo . . . . . 0 N--CA 1.458 -0.597 0 C-N-CA 122.19 1.927 . . . . 0.0 113.042 -177.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.722 ' HA2' ' HB3' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.442 -0.909 0 N-CA-C 112.47 -0.252 . . . . 0.0 112.47 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.552 ' H ' ' HE2' ' A' ' 116' ' ' TYR . 7.3 ttt85 -159.85 133.41 7.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.85 0.357 . . . . 0.0 110.185 -175.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 71' ' ' TRP . 75.4 mmtt -77.66 -25.64 49.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.12 -175.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -57.9 -52.91 63.56 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.315 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.678 HD12 HG12 ' A' ' 98' ' ' ILE . 0.1 OUTLIER -68.37 -23.13 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.71 -178.499 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.546 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 1.8 m95 -50.99 -34.33 28.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 111.481 -178.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.751 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 17.2 t70 -56.89 -39.87 75.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.829 177.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.74 -27.08 60.99 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.227 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.512 HD11 ' SG ' ' A' ' 108' ' ' CYS . 24.6 mt -68.92 -43.65 74.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.751 ' HE2' ' HA ' ' A' ' 72' ' ' ASP . 8.4 mtmt -64.95 -46.3 82.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -57.74 -43.93 85.71 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.669 178.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.522 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -68.01 -52.31 37.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.725 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.488 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -50.0 -35.28 24.0 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 123.451 0.469 . . . . 0.0 110.462 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.508 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 21.4 t60 -60.68 -52.24 65.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.28 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -67.68 -52.53 36.84 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.705 177.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -51.31 -36.12 41.12 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.782 178.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -57.49 -39.22 75.99 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.183 0.516 . . . . 0.0 111.138 175.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.5 t -87.63 23.72 1.89 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.214 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 71.89 5.2 5.28 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.072 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.542 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 8.8 t0 -79.58 89.63 5.1 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.491 0.662 . . . . 0.0 110.418 -178.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 56.8 m80 -70.74 -35.82 72.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.008 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.577 ' HA ' HE21 ' A' ' 90' ' ' GLN . 9.4 pt-20 -70.22 -44.39 68.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.833 -170.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.448 ' O ' HG13 ' A' ' 92' ' ' ILE . 13.3 mt -60.65 -54.42 45.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.819 0.342 . . . . 0.0 111.316 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.499 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.71 -42.87 94.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.908 -174.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.577 HE21 ' HA ' ' A' ' 87' ' ' GLU . 25.8 pt20 -70.57 -32.89 70.46 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.68 -24.21 49.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 88' ' ' LEU . 41.2 mt -72.26 -57.7 6.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.391 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.504 ' CG2' HG22 ' A' ' 98' ' ' ILE . 9.6 mm -50.0 -57.49 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.839 174.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . 0.617 ' OD2' ' HB2' ' A' ' 29' ' ' ASN . 3.9 t70 -64.4 -31.53 72.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.852 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -74.36 -10.21 81.88 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.391 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.5 -0.68 51.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.681 -0.305 . . . . 0.0 110.415 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 74.73 7.86 4.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 122.024 0.916 . . . . 0.0 109.071 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.97 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -87.38 137.09 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 114.455 -1.248 . . . . 0.0 108.74 172.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.701 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 40.1 p -120.37 166.09 14.01 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.218 -175.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.727 HD12 ' H ' ' A' ' 104' ' ' ALA . 1.6 tm? -149.47 101.44 3.3 Favored Pre-proline 0 N--CA 1.446 -0.658 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.666 176.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.613 ' HD2' HD22 ' A' ' 100' ' ' LEU . 26.4 Cg_endo -61.39 -16.79 49.43 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.801 3.001 . . . . 0.0 113.871 -172.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.669 ' H ' HD13 ' A' ' 100' ' ' LEU . 56.3 m-70 -82.83 -18.69 39.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.06 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . 0.776 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 80.01 9.98 86.08 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.98 -0.628 . . . . 0.0 112.386 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.727 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -98.84 148.2 24.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.259 0.552 . . . . 0.0 111.776 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.6 tm? -79.15 -17.67 54.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 174.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.85 HG22 HD13 ' A' ' 123' ' ' LEU . 52.4 p -87.57 21.18 2.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.019 -171.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.486 ' HB3' HD21 ' A' ' 100' ' ' LEU . 49.1 mt-10 -157.12 160.37 38.77 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.681 ' SG ' ' HB2' ' A' ' 116' ' ' TYR . 13.3 p -154.8 139.37 16.92 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.318 174.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.452 ' HD1' ' O ' ' A' ' 108' ' ' CYS . 11.8 m-30 -118.52 120.86 38.78 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ASP . . . . . 0.988 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 5.0 t70 -80.69 145.23 31.7 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.674 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -60.01 -22.28 62.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.868 -170.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.18 28.65 4.31 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.311 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.988 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 60.7 m-80 -98.97 158.65 15.51 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.984 -0.127 . . . . 0.0 110.796 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -139.34 139.65 37.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.331 . . . . 0.0 111.467 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . 0.681 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 27.6 m-85 -136.67 152.75 50.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.113 175.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.448 ' O ' ' HD3' ' A' ' 119' ' ' PRO . 10.2 mm100 -122.05 120.83 35.49 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.633 ' HB2' ' C ' ' A' ' 106' ' ' THR . 4.1 mm? -90.06 109.79 35.55 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-O 121.143 0.497 . . . . 0.0 111.512 -176.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.537 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 22.1 Cg_exo -74.74 156.09 44.18 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 124.152 3.235 . . . . 0.0 113.633 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.99 HG22 ' HE1' ' A' ' 39' ' ' TRP . 4.9 m -63.63 -16.68 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.735 -1.12 . . . . 0.0 113.178 -173.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.537 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.2 p90 -58.35 -23.54 57.14 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -169.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 39.4 t -129.84 27.35 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.096 0.474 . . . . 0.0 109.877 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.85 HD13 HG22 ' A' ' 106' ' ' THR . 95.1 mt -138.27 -50.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.917 -176.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -135.08 111.5 11.03 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 120.962 0.41 . . . . 0.0 111.833 -175.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.655 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 31.6 Cg_exo -61.51 -43.57 26.8 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.545 2.83 . . . . 0.0 115.271 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.655 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 16.3 Cg_exo -29.68 -56.87 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 124.866 3.711 . . . . 0.0 115.63 -174.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.941 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.327 -0.402 0 CA-C-O 121.111 0.481 . . . . 0.0 111.853 -176.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 C--O 1.233 0.214 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.522 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 31.0 p-10 -99.31 159.61 14.88 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.851 -172.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.624 ' CD ' ' H ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -84.37 110.27 25.52 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.229 -165.149 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.566 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.6 Cg_exo -70.75 -162.91 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 124.056 3.171 . . . . 0.0 112.666 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.684 ' H ' HD12 ' A' ' 32' ' ' LEU . 6.5 mp -41.52 139.25 1.15 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.408 0.683 . . . . 0.0 112.798 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.981 ' HE2' ' HG2' ' A' ' 90' ' ' GLN . 2.3 mptp? -89.8 74.45 7.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.629 -176.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.92 -15.4 19.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.446 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.41 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 19.9 tt0 -77.03 156.91 31.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.491 0.662 . . . . 0.0 111.008 -178.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.425 ' H ' ' HG2' ' A' ' 36' ' ' LYS . 8.5 pttt -94.97 159.23 33.57 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.038 -172.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HB2' HG12 ' A' ' 120' ' ' VAL . 12.2 Cg_exo -68.86 144.83 60.34 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.055 1.837 . . . . 0.0 111.296 174.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.699 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 31.9 ttpt -111.04 145.19 38.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.303 -170.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 1.051 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.0 OUTLIER 134.75 -9.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 O-C-N 125.429 1.706 . . . . 0.0 109.775 -179.348 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.614 ' HG2' HG11 ' A' ' 120' ' ' VAL . 0.0 OUTLIER -113.61 168.89 9.38 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.386 0.612 . . . . 0.0 111.396 -171.049 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.2 m -85.82 133.13 33.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.287 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.3 -27.85 66.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.444 0.64 . . . . 0.0 109.338 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -141.43 84.4 12.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.892 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.49 144.36 60.83 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.825 2.35 . . . . 0.0 111.805 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.545 ' HB3' ' H ' ' A' ' 46' ' ' THR . 0.0 OUTLIER -127.21 -135.25 0.24 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.279 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.545 ' H ' ' HB3' ' A' ' 45' ' ' MET . 69.0 p -73.1 170.05 15.73 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -171.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 20.4 t70 -55.15 -37.88 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.617 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.44 -36.59 63.97 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.109 177.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -75.42 -39.16 59.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 54.8 tp -58.66 -53.18 61.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.903 178.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 16.4 ptp180 -60.72 -46.83 88.9 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.082 -178.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 18.2 m -65.2 -47.66 76.14 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.947 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.594 ' C ' ' HD2' ' A' ' 53' ' ' LYS . 4.5 tmmm? -56.95 -45.75 82.59 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.135 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -53.5 -53.47 50.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.429 -174.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.1 -50.4 48.48 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.051 0.453 . . . . 0.0 111.147 -177.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 1.7 tm-20 -54.56 -49.87 69.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.836 -177.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.411 ' CE1' ' HG2' ' A' ' 53' ' ' LYS . 12.1 m-85 -71.48 -39.05 71.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.622 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.493 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 1.9 m95 -56.91 -23.08 42.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . 0.488 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 7.5 t70 -65.9 -37.24 85.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.858 0.361 . . . . 0.0 111.351 173.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.2 m -107.91 -22.08 12.58 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -169.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.598 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -60.46 -59.19 14.63 Favored Pre-proline 0 CA--C 1.538 0.512 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.598 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 88.0 Cg_endo . . . . . 0 C--N 1.349 0.56 0 C-N-CA 122.073 1.849 . . . . 0.0 112.953 -174.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.436 ' HA3' ' CZ ' ' A' ' 116' ' ' TYR . . . . . . . . 0 N--CA 1.44 -1.073 0 N-CA-C 111.421 -0.672 . . . . 0.0 111.421 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 67' ' ' ARG . 68.6 mmt-85 -102.9 116.69 33.03 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.411 ' HD2' ' OE1' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -77.63 -15.92 58.88 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.776 0.322 . . . . 0.0 110.807 -177.668 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.411 ' OE1' ' HD2' ' A' ' 68' ' ' LYS . 6.8 mp0 -60.57 -41.98 95.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.244 175.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.563 ' O ' HG12 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -82.98 -19.84 9.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.36 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.52 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -46.57 -41.42 14.41 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 122.569 0.348 . . . . 0.0 111.891 -176.241 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.504 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 10.4 m-20 -59.8 -32.63 70.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.18 -35.15 66.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.09 0.471 . . . . 0.0 109.919 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.419 HD21 HD13 ' A' ' 70' ' ' ILE . 25.4 mt -66.22 -48.65 69.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.594 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 14.3 ptpt -68.78 -28.03 66.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.855 179.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -73.2 -36.9 66.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.916 0.388 . . . . 0.0 110.672 176.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.67 -48.0 65.06 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.475 176.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -52.76 -34.3 52.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.826 172.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.414 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 35.4 t60 -64.4 -51.9 60.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.948 0.404 . . . . 0.0 109.929 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.438 ' HB1' ' HB2' ' A' ' 88' ' ' LEU . . . -64.1 -55.56 21.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.187 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -52.68 -34.81 53.64 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.642 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.012 0.434 . . . . 0.0 111.395 176.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 7.1 t -85.31 15.55 4.27 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.441 ' HB2' ' O ' ' A' ' 83' ' ' SER . 36.3 m-80 73.6 5.18 4.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.589 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 80' ' ' ALA . 1.7 m-20 -77.21 84.62 3.68 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.859 0.837 . . . . 0.0 110.584 176.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.662 ' HE2' ' HA ' ' A' ' 32' ' ' LEU . 12.6 t-80 -70.36 -39.59 74.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.256 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -60.28 -44.0 95.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.387 -178.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.441 ' O ' HG13 ' A' ' 92' ' ' ILE . 12.7 mt -63.71 -51.48 64.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.736 -177.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.588 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -60.55 -39.29 87.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.605 -175.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.981 ' HG2' ' HE2' ' A' ' 33' ' ' LYS . 9.2 mt-30 -65.46 -43.67 89.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.705 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -21.17 64.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.029 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.4 mt -82.12 -60.94 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.505 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 89' ' ' ALA . 9.3 mm -55.23 -54.34 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.829 0.347 . . . . 0.0 111.253 178.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.48 -33.19 75.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.273 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -69.97 -14.44 70.72 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.225 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -95.99 3.72 53.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 84.5 m-20 75.89 7.6 3.69 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.688 0.617 . . . . 0.0 109.621 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.915 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -89.94 139.47 17.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.036 -0.984 . . . . 0.0 109.831 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 p -124.26 162.74 23.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.222 0.535 . . . . 0.0 111.619 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.72 HD13 ' H ' ' A' ' 102' ' ' HIS . 1.7 tm? -150.1 109.83 3.25 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.463 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.631 ' HD2' HD22 ' A' ' 100' ' ' LEU . 38.0 Cg_endo -64.71 -24.01 62.61 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.185 2.59 . . . . 0.0 113.655 -172.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.72 ' H ' HD13 ' A' ' 100' ' ' LEU . 11.3 m170 -76.29 -18.75 58.81 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.784 0.325 . . . . 0.0 111.283 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . 0.566 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 80.51 11.68 83.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.702 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.581 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -93.29 152.02 19.43 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.297 0.57 . . . . 0.0 111.56 -173.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.885 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 2.8 tm? -84.89 -23.36 28.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.209 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.443 HG21 ' HG3' ' A' ' 37' ' ' PRO . 47.0 p -88.46 17.62 5.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.53 -174.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.604 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 66.4 mt-10 -150.5 143.21 24.57 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 81.8 m -152.01 139.24 19.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.886 0.374 . . . . 0.0 111.519 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.559 ' HE1' ' HG3' ' A' ' 115' ' ' ARG . 19.7 m-30 -118.94 122.02 41.27 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.469 0.652 . . . . 0.0 109.46 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ASP . . . . . 0.965 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.9 t70 -83.32 145.42 29.08 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.009 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.89 -27.49 60.68 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 124.451 1.095 . . . . 0.0 112.271 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.0 mt -76.47 -11.91 59.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.453 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.66 30.22 3.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.253 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.965 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 57.3 m-80 -98.76 157.92 15.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.744 0.307 . . . . 0.0 110.952 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.559 ' HG3' ' HE1' ' A' ' 109' ' ' TYR . 11.4 ttm180 -134.53 122.53 22.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 -174.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . 0.436 ' CZ ' ' HA3' ' A' ' 66' ' ' GLY . 38.5 m-85 -120.85 124.8 45.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.375 175.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -122.34 121.37 36.55 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.489 HD23 HD11 ' A' ' 123' ' ' LEU . 21.5 tp -98.65 122.2 53.98 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -166.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.568 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 11.2 Cg_exo -74.84 157.38 43.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.974 3.116 . . . . 0.0 113.215 177.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.051 HG22 ' HE1' ' A' ' 39' ' ' TRP . 20.4 m -72.58 -10.03 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.798 -175.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.568 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.1 p90 -56.24 -24.11 40.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -170.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 52.2 t -113.4 3.53 15.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.74 0.305 . . . . 0.0 111.111 -176.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.489 HD11 HD23 ' A' ' 118' ' ' LEU . 20.0 mt -125.47 -53.61 1.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.848 0.356 . . . . 0.0 111.842 -174.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.623 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -136.15 111.59 10.13 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.691 0.281 . . . . 0.0 110.764 -176.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.511 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 11.1 Cg_endo -92.78 6.7 3.07 Favored 'Trans proline' 0 CA--C 1.559 1.764 0 C-N-CA 123.281 2.654 . . . . 0.0 117.379 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.623 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 17.4 Cg_endo -59.29 -31.57 95.32 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 122.921 2.079 . . . . 0.0 111.776 174.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.694 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.326 -0.442 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.091 178.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 28' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 121.039 0.447 . . . . 0.0 111.231 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.493 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -101.08 157.96 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.349 176.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.788 ' HB3' ' HA2' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -87.19 117.67 68.92 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -168.829 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.784 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 13.4 Cg_exo -72.17 -163.4 0.14 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.227 2.618 . . . . 0.0 111.476 164.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.455 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.2 mp -59.99 142.86 53.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.808 0.337 . . . . 0.0 110.985 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.552 ' HE3' ' HB2' ' A' ' 86' ' ' HIS . 0.0 OUTLIER -78.02 71.98 4.52 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.274 0.559 . . . . 0.0 111.586 -178.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -87.29 -17.3 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.547 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.27 169.56 17.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.528 0.68 . . . . 0.0 111.729 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -108.62 149.72 39.8 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.215 -176.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.614 ' HG3' HG21 ' A' ' 106' ' ' THR . 22.9 Cg_exo -60.8 138.75 81.35 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.566 2.177 . . . . 0.0 111.665 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.506 ' HE2' ' HB3' ' A' ' 38' ' ' LYS . 3.4 tmmm? -111.17 122.47 47.96 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.891 0.853 . . . . 0.0 112.761 -170.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 1.047 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.9 p-90 175.04 23.26 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 113.058 -1.883 . . . . 0.0 108.159 172.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.601 ' HE2' HG12 ' A' ' 127' ' ' ILE . 1.8 tmmt? -142.24 149.55 39.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.444 -156.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.502 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 57.7 m -66.75 119.64 12.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.373 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -64.54 -25.56 68.04 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -130.16 83.6 62.66 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.592 171.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -70.03 141.38 43.96 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.636 2.224 . . . . 0.0 112.35 -178.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -116.75 -135.63 0.35 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 37.3 p -72.93 -179.88 3.4 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.7 p-10 -65.68 -37.19 85.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.737 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.8 -38.82 96.71 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.026 -0.607 . . . . 0.0 111.633 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.884 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -71.68 -33.55 68.93 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.612 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.698 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 3.2 tm? -60.49 -52.7 64.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.322 178.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.48 ' HG3' ' N ' ' A' ' 52' ' ' SER . 6.6 ptm180 -65.1 -54.9 22.78 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -176.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.48 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 47.7 m -62.75 -50.9 69.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.421 -174.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.468 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 0.1 OUTLIER -67.94 -28.37 67.41 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.903 -177.718 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.698 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.2 -39.48 94.75 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.801 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.82 -48.32 66.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.243 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.03 -52.41 43.32 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.468 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 17.8 m-85 -59.97 -40.04 87.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.531 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -25.0 61.41 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -73.72 -32.47 63.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.115 0.483 . . . . 0.0 110.859 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 m -92.32 -23.43 19.26 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.324 -174.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.682 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -59.98 -67.02 1.15 Allowed Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.682 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 88.8 Cg_endo . . . . . 0 C--N 1.351 0.683 0 C-N-CA 121.52 1.48 . . . . 0.0 112.462 -175.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . 0.506 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . . . . . . 0 N--CA 1.444 -0.794 0 N-CA-C 112.786 -0.126 . . . . 0.0 112.786 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.688 ' HB3' HG22 ' A' ' 70' ' ' ILE . 7.7 tpt180 -81.12 112.75 18.77 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.567 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 14.3 tptm -61.57 -33.02 73.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.915 0.388 . . . . 0.0 110.584 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.72 -45.18 82.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.62 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.688 HG22 ' HB3' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -77.27 -21.18 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.198 -177.507 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.567 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.32 -42.92 22.23 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.28 0.562 . . . . 0.0 111.208 -176.563 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . 0.549 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 7.9 m-20 -66.04 -25.57 67.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.894 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.6 -29.78 46.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.4 0.619 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.419 HD21 ' CD1' ' A' ' 70' ' ' ILE . 17.2 mt -70.19 -51.2 32.92 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.506 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.549 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 13.2 ptpt -64.89 -32.74 74.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.867 178.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.26 -35.57 73.88 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.752 0.311 . . . . 0.0 110.945 176.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -68.87 -46.91 67.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.484 176.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.572 ' HB1' HD21 ' A' ' 123' ' ' LEU . . . -52.59 -36.02 55.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.419 173.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.526 ' O ' ' HB2' ' A' ' 82' ' ' GLU . 63.6 t60 -62.98 -47.09 84.65 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.342 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.06 -51.32 59.26 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.56 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.551 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 1.8 t80 -54.04 -34.7 60.72 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.891 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 28.6 mt-10 -51.37 -48.72 62.43 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 175.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . 0.561 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 15.2 m -76.41 -19.69 57.85 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.731 -173.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' A' ' 83' ' ' SER . 9.7 t30 138.93 -17.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.226 0 O-C-N 124.947 1.405 . . . . 0.0 109.846 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.589 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 0.2 OUTLIER -71.73 90.63 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -165.106 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.704 ' O ' ' HG2' ' A' ' 90' ' ' GLN . 27.4 t-80 -70.45 -44.99 66.66 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.011 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . 0.508 ' H ' ' CD ' ' A' ' 87' ' ' GLU . 1.7 pm0 -62.96 -47.03 84.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.73 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.525 ' O ' HG13 ' A' ' 92' ' ' ILE . 4.2 mt -54.45 -56.36 19.52 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.251 0.548 . . . . 0.0 110.838 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.795 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -61.31 -42.64 99.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.766 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.704 ' HG2' ' O ' ' A' ' 86' ' ' HIS . 22.6 mm-40 -63.74 -38.45 91.14 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.171 -0.211 . . . . 0.0 111.18 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.77 -30.77 69.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.906 0.384 . . . . 0.0 110.284 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 88' ' ' LEU . 57.2 mt -69.71 -59.97 2.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.851 178.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.567 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.5 mm -52.4 -57.17 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.134 0.492 . . . . 0.0 111.005 178.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -64.56 -24.49 67.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.042 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.57 -19.2 68.78 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.697 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -101.53 4.24 40.89 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.692 -0.299 . . . . 0.0 110.603 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 3.7 m-20 72.9 8.11 5.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.565 0.698 . . . . 0.0 110.107 -174.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.968 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.6 mp -82.05 136.92 22.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.82 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.521 ' HA ' ' OE1' ' A' ' 30' ' ' GLN . 25.6 p -138.61 171.18 14.73 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.409 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.784 HD13 ' H ' ' A' ' 102' ' ' HIS . 1.5 tm? -148.52 114.33 3.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.582 ' HD2' HD22 ' A' ' 100' ' ' LEU . 34.7 Cg_endo -65.13 -17.62 59.32 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.492 2.795 . . . . 0.0 114.558 -174.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.784 ' H ' HD13 ' A' ' 100' ' ' LEU . 18.8 m-70 -79.93 -23.22 41.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.179 0.514 . . . . 0.0 111.033 177.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . 0.788 ' HA2' ' HB3' ' A' ' 30' ' ' GLN . . . 75.99 17.29 80.12 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.392 -0.909 . . . . 0.0 111.567 -172.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -94.96 141.38 28.72 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 121.168 0.509 . . . . 0.0 110.406 -176.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.795 HD21 ' HB1' ' A' ' 89' ' ' ALA . 0.3 OUTLIER -75.29 -21.63 58.34 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.9 -1.046 . . . . 0.0 109.005 179.122 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.614 HG21 ' HG3' ' A' ' 37' ' ' PRO . 64.4 p -90.71 15.05 11.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.936 -173.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.585 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.4 mt-10 -148.55 143.87 26.91 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 175.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.8 m -150.75 139.17 20.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.524 0.202 . . . . 0.0 110.523 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -118.92 123.16 43.96 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.343 0.592 . . . . 0.0 109.967 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ASP . . . . . 0.968 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.3 t70 -87.11 147.22 25.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.503 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.55 -24.71 57.63 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.112 -172.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.4 ' HG ' ' OD1' ' A' ' 110' ' ' ASP . 27.4 mt -76.71 -3.04 35.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 110.938 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.11 34.39 6.48 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 0.787 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 11.6 m120 -106.6 157.88 17.35 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -139.95 139.16 36.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.229 0.537 . . . . 0.0 110.942 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . 0.424 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 40.1 m-85 -124.91 127.75 47.57 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.921 175.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -121.38 122.52 40.01 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -176.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.456 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 30.8 tp -102.53 123.29 43.28 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.065 -167.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.653 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 20.4 Cg_exo -69.48 155.76 65.94 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.737 2.958 . . . . 0.0 112.751 176.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 1.047 HG22 ' HE1' ' A' ' 39' ' ' TRP . 20.2 m -66.17 -17.71 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.656 -175.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.653 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.3 p90 -60.65 -22.14 63.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -166.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.7 t -110.59 1.48 18.1 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.601 -174.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.572 HD21 ' HB1' ' A' ' 78' ' ' ALA . 90.3 mt -130.31 -37.02 1.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 0.0 111.808 -177.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.427 ' HB3' ' HB ' ' A' ' 120' ' ' VAL . . . -117.46 112.53 39.19 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.439 -175.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.552 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 51.3 Cg_exo -56.38 -34.91 95.51 Favored 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.648 2.899 . . . . 0.0 115.674 177.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 48.8 Cg_endo -67.31 -149.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.365 1.444 0 C-N-CA 121.778 1.652 . . . . 0.0 112.459 175.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.601 HG12 ' HE2' ' A' ' 40' ' ' LYS . 4.0 mp . . . . . 0 C--O 1.232 0.146 0 CA-C-O 122.383 1.087 . . . . 0.0 109.759 -174.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.633 ' O ' ' HB ' ' A' ' 99' ' ' THR . 10.8 mtm180 . . . . . 0 CA--C 1.521 -0.166 0 CA-C-O 121.036 0.446 . . . . 0.0 110.751 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.452 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 26.1 p-10 -91.1 156.75 17.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.621 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.877 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 3.7 pm0 -88.78 118.16 69.03 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 121.787 0.804 . . . . 0.0 112.219 -170.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.664 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 5.2 Cg_exo -77.4 -164.38 0.26 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.493 2.795 . . . . 0.0 111.435 169.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LEU . . . . . 0.537 ' HG ' ' NE2' ' A' ' 86' ' ' HIS . 7.7 tt -40.82 120.71 1.35 Allowed 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 173.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LYS . . . . . 0.779 ' HB3' ' H ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -56.83 121.75 10.6 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 121.473 0.654 . . . . 0.0 111.655 -177.426 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -95.2 -33.92 12.43 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.395 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.14 170.1 12.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.516 174.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -110.53 162.37 20.83 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.56 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PRO . . . . . 0.56 ' HB2' HG12 ' A' ' 120' ' ' VAL . 22.0 Cg_exo -59.98 123.26 12.83 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.625 1.55 . . . . 0.0 110.839 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 3.4 tmmm? -108.09 122.14 46.28 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.891 0.853 . . . . 0.0 112.207 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' TRP . . . . . 0.999 ' HE1' HG22 ' A' ' 120' ' ' VAL . 2.5 p-90 171.08 24.27 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.795 -2.002 . . . . 0.0 107.882 177.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.573 ' HD2' ' N ' ' A' ' 41' ' ' SER . 1.2 tmmt? -141.13 152.88 45.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.298 -153.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . 0.573 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 48.2 m -64.62 127.29 30.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.447 -177.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -61.72 -29.54 70.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.86 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -147.56 95.95 4.21 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.693 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.52 129.02 13.24 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.667 2.244 . . . . 0.0 111.866 176.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' MET . . . . . 0.633 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.6 mtp -94.27 -85.27 0.3 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.057 -179.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.0 p -114.85 -178.16 3.3 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.423 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . 0.5 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 9.0 p-10 -69.22 -33.36 73.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.81 0.338 . . . . 0.0 110.336 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.71 -38.05 95.62 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.619 176.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.633 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 15.7 mm100 -70.94 -41.54 71.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.856 0.36 . . . . 0.0 110.181 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.74 -50.42 73.27 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.455 -179.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 7.2 ptm180 -66.51 -42.41 87.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.7 t -65.61 -52.08 54.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.924 0.392 . . . . 0.0 110.286 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.45 ' HG3' ' CE2' ' A' ' 57' ' ' PHE . 3.4 tppt? -63.1 -35.28 79.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.431 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -56.81 -46.94 81.29 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.902 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.48 -46.11 73.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.003 0.43 . . . . 0.0 110.86 -177.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -53.44 -49.57 67.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.799 175.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.45 ' CE2' ' HG3' ' A' ' 53' ' ' LYS . 19.0 m-85 -63.22 -43.91 96.76 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.1 176.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' TRP . . . . . 0.424 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 0.1 OUTLIER -49.6 -36.06 22.89 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 178.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -70.16 -26.12 63.77 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.6 m -96.12 -24.31 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.757 0.789 . . . . 0.0 109.821 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.539 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -68.32 159.18 82.02 Favored Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.405 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.539 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 21.4 Cg_endo . . . . . 0 N--CA 1.46 -0.45 0 C-N-CA 122.99 2.46 . . . . 0.0 112.713 -173.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.443 -0.848 0 N-CA-C 111.576 -0.61 . . . . 0.0 111.576 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 67' ' ' ARG . 37.7 mtt180 -65.89 109.75 2.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.962 0.41 . . . . 0.0 110.266 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.748 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 72.9 mmtt -64.84 -23.41 67.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.681 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLU . . . . . 0.401 ' HG3' ' H ' ' A' ' 69' ' ' GLU . 22.6 mt-10 -52.51 -53.63 43.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.031 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.772 HG13 HD13 ' A' ' 98' ' ' ILE . 0.0 OUTLIER -82.84 -25.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.668 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' TRP . . . . . 0.748 ' HB2' ' HA ' ' A' ' 68' ' ' LYS . 5.9 m95 -52.41 -35.95 53.14 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.053 177.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -55.68 -39.35 70.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.426 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.35 -28.76 37.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 110.382 -175.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.49 HD21 ' CD1' ' A' ' 70' ' ' ILE . 21.8 mt -64.65 -49.87 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.25 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.635 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 10.7 ptpt -73.43 -26.68 61.05 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.093 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -67.33 -41.11 85.77 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.895 0.379 . . . . 0.0 110.636 175.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -66.94 -50.93 60.82 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.206 176.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ALA . . . . . 0.586 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -51.29 -32.89 26.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.733 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' HIS . . . . . 0.488 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 65.5 t60 -62.56 -50.67 70.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.894 0.378 . . . . 0.0 110.468 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.08 -52.06 52.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.559 177.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.466 ' CE1' ' HD2' ' A' ' 33' ' ' LYS . 10.4 t80 -55.68 -26.79 46.65 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.32 178.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.586 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.0 mt-10 -57.22 -34.56 68.68 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.671 -0.643 . . . . 0.0 110.785 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.5 t -90.77 16.62 8.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.461 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.8 t30 70.68 8.52 6.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.397 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.58 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 11.0 t0 -76.07 93.37 3.3 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.784 -177.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' HIS . . . . . 0.641 ' O ' ' HG3' ' A' ' 90' ' ' GLN . 66.2 m80 -71.37 -50.79 28.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.777 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -58.61 -40.65 83.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.191 -171.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.535 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.8 mt -59.01 -52.48 65.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.89 0.376 . . . . 0.0 110.812 176.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.891 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -65.59 -40.02 92.22 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.467 -175.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' A' ' 86' ' ' HIS . 19.9 mt-30 -58.08 -46.59 85.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.468 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.15 -25.08 60.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.724 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 88' ' ' LEU . 46.4 mt -69.91 -59.43 3.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.641 0.258 . . . . 0.0 110.628 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ILE . . . . . 0.534 ' CG2' HG22 ' A' ' 98' ' ' ILE . 10.6 mm -53.04 -59.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.301 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -63.93 -25.26 68.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.364 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.97 56.11 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.622 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . 0.624 ' HB3' HD12 ' A' ' 98' ' ' ILE . . . -112.41 15.89 20.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 122.548 -0.384 . . . . 0.0 111.574 -179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 72.2 9.72 5.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 122.041 0.924 . . . . 0.0 108.948 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ILE . . . . . 0.772 HD13 HG13 ' A' ' 70' ' ' ILE . 50.3 mt -96.25 138.03 22.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.594 -176.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' THR . . . . . 0.633 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 34.3 p -139.13 168.66 19.34 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.227 -0.589 . . . . 0.0 112.178 -170.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' LEU . . . . . 0.92 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.7 tm? -149.38 99.62 3.39 Favored Pre-proline 0 N--CA 1.452 -0.354 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.086 174.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' PRO . . . . . 0.492 ' HD2' HD22 ' A' ' 100' ' ' LEU . 56.0 Cg_endo -66.68 -10.72 29.07 Favored 'Trans proline' 0 N--CA 1.475 0.383 0 C-N-CA 123.433 2.756 . . . . 0.0 113.29 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' HIS . . . . . 0.679 ' H ' HD13 ' A' ' 100' ' ' LEU . 48.8 m170 -84.02 -9.85 58.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.702 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLY . . . . . 0.664 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 67.84 38.15 89.03 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.623 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ALA . . . . . 0.92 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -122.67 139.39 54.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.287 0.565 . . . . 0.0 111.391 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.891 HD21 ' HB1' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -76.9 -22.08 53.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.043 -0.98 . . . . 0.0 108.412 176.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.578 HG22 HD13 ' A' ' 123' ' ' LEU . 59.1 p -91.84 18.11 8.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.606 -172.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.7 mt-10 -150.62 149.14 29.49 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 171.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.445 ' SG ' HD22 ' A' ' 74' ' ' LEU . 80.6 m -150.55 144.09 25.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.798 0.332 . . . . 0.0 110.416 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . 0.642 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 18.0 m-30 -118.48 121.73 40.99 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.093 0.473 . . . . 0.0 109.835 177.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ASP . . . . . 1.051 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.3 t70 -79.78 145.18 32.98 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.597 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -59.6 -24.47 63.82 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.967 -168.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 mt -76.82 -13.73 59.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.118 0.485 . . . . 0.0 110.495 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.23 28.05 3.2 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.452 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASN . . . . . 1.051 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 51.5 m-80 -94.1 143.01 26.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.794 0.297 . . . . 0.0 110.766 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.642 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 53.2 ttp180 -123.3 121.19 35.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -127.16 140.7 52.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.942 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' GLN . . . . . 0.458 ' O ' ' HG3' ' A' ' 62' ' ' PRO . 25.8 mt-30 -123.11 146.36 47.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' LEU . . . . . 0.706 HD12 ' HD2' ' A' ' 119' ' ' PRO . 15.8 tp -111.96 121.98 38.15 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -167.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' PRO . . . . . 0.706 ' HD2' HD12 ' A' ' 118' ' ' LEU . 14.5 Cg_exo -72.13 157.49 54.01 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.847 3.031 . . . . 0.0 113.372 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' VAL . . . . . 0.999 HG22 ' HE1' ' A' ' 39' ' ' TRP . 9.3 m -69.62 -14.41 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.385 -175.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' TYR . . . . . 0.586 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -56.46 -22.3 31.28 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -168.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 40.7 t -124.75 16.41 8.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.818 0.342 . . . . 0.0 110.919 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' LEU . . . . . 0.578 HD13 HG22 ' A' ' 106' ' ' THR . 72.7 mt -131.63 -54.34 1.01 Allowed 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.138 -0.351 . . . . 0.0 111.705 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' ALA . . . . . 0.528 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -129.98 111.74 17.17 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.828 0.346 . . . . 0.0 110.583 -175.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' PRO . . . . . 0.44 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 89.8 Cg_endo -87.54 -4.67 7.4 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.029 2.486 . . . . 0.0 117.787 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' PRO . . . . . 0.528 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 30.6 Cg_endo -63.89 -26.31 67.14 Favored 'Trans proline' 0 C--N 1.371 1.734 0 CA-C-N 123.076 2.134 . . . . 0.0 112.499 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' ILE . . . . . 0.786 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.2 OUTLIER . . . . . 0 C--N 1.327 -0.396 0 CA-C-O 121.438 0.637 . . . . 0.0 110.107 179.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.7 t . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 8.3 mp -80.35 96.54 6.71 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.783 0.325 . . . . 0.0 111.476 -175.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 8.5 t30 53.06 71.54 0.48 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.792 177.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -124.89 105.35 9.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.188 -179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -118.47 35.79 4.64 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 175.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.9 p 48.15 57.55 6.01 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.122 -0.944 . . . . 0.0 110.987 -175.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -103.07 121.94 43.62 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.188 -0.914 . . . . 0.0 109.545 -179.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 89.72 1.03 77.86 Favored Glycine 0 N--CA 1.448 -0.546 0 C-N-CA 120.829 -0.701 . . . . 0.0 111.704 -175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 5.2 t -151.35 134.99 16.32 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.922 0.392 . . . . 0.0 110.215 -179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -73.42 96.53 0.82 Allowed Glycine 0 N--CA 1.447 -0.631 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.387 -179.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.9 t 71.93 124.35 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.465 0.31 0 C-N-CA 123.329 0.652 . . . . 0.0 111.491 178.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.73 -68.24 0.76 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.378 179.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.819 ' H ' HD12 ' A' ' 26' ' ' LEU . 0.7 OUTLIER -69.42 -23.88 63.76 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.658 0.742 . . . . 0.0 110.269 -179.264 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.496 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 103.99 103.17 2.79 Favored Glycine 0 N--CA 1.441 -0.985 0 N-CA-C 109.503 -1.439 . . . . 0.0 109.503 -169.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.55 ' O ' ' HB ' ' A' ' 99' ' ' THR . 2.4 ppt_? -75.02 -8.58 56.94 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 -173.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.403 ' HB3' ' NH1' ' A' ' 28' ' ' ARG . 3.5 p-10 -94.89 149.2 21.5 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 109.342 -0.614 . . . . 0.0 109.342 173.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.782 ' HG3' ' HA2' ' A' ' 103' ' ' GLY . 7.9 tt0 -83.62 119.09 73.2 Favored Pre-proline 0 C--N 1.327 -0.408 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -165.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.535 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 5.8 Cg_exo -78.6 -164.53 0.28 Allowed 'Trans proline' 0 CA--C 1.537 0.626 0 C-N-CA 123.876 3.051 . . . . 0.0 112.125 171.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 16.1 tp -52.3 132.78 34.46 Favored 'General case' 0 C--O 1.235 0.338 0 C-N-CA 122.777 0.431 . . . . 0.0 111.183 178.363 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.727 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -80.76 87.81 5.84 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.273 0.559 . . . . 0.0 111.435 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.669 ' HD2' ' N ' ' A' ' 35' ' ' GLU . 0.0 OUTLIER -98.5 -25.06 14.89 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.106 175.913 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.669 ' N ' ' HD2' ' A' ' 34' ' ' LYS . 0.4 OUTLIER -50.73 151.32 2.45 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.329 -1.305 . . . . 0.0 112.389 -178.326 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.721 ' H ' ' HD2' ' A' ' 36' ' ' LYS . 1.2 mptt -96.05 159.95 31.06 Favored Pre-proline 0 C--N 1.326 -0.435 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.681 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.605 ' HB2' HG12 ' A' ' 120' ' ' VAL . 13.8 Cg_exo -67.44 135.88 37.93 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.88 1.72 . . . . 0.0 111.063 174.079 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.65 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 32.5 ttpt -111.71 141.47 45.28 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 116.276 -0.42 . . . . 0.0 112.078 -168.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 1.071 ' HE1' HG22 ' A' ' 120' ' ' VAL . 3.1 p-90 147.51 -13.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.172 0 O-C-N 125.281 1.613 . . . . 0.0 110.357 -178.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.603 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.73 171.28 7.68 Favored 'General case' 0 N--CA 1.454 -0.259 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.042 -176.847 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.467 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 15.0 m -64.61 133.28 51.94 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.776 -179.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 7.6 p-10 -71.43 -31.86 67.7 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 176.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 48.9 t80 -129.51 85.24 59.38 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.84 170.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.467 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 4.3 Cg_exo -75.86 134.23 16.2 Favored 'Trans proline' 0 N--CA 1.454 -0.818 0 C-N-CA 122.417 2.078 . . . . 0.0 110.534 173.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.703 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 90.8 mtp -102.98 -81.99 0.5 Allowed 'General case' 0 C--N 1.319 -0.718 0 CA-C-O 120.963 0.411 . . . . 0.0 110.699 -178.513 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.844 HG21 HD22 ' A' ' 139' ' ' LEU . 75.4 p -115.37 -177.12 3.07 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.218 178.398 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -53.14 -49.64 66.17 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 123.263 0.352 . . . . 0.0 111.197 179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -57.57 -48.03 84.16 Favored Glycine 0 C--O 1.228 -0.274 0 C-N-CA 120.938 -0.649 . . . . 0.0 112.127 179.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.703 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 75.3 mm-40 -61.82 -45.08 95.38 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.87 0.367 . . . . 0.0 110.965 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.505 HD22 HG12 ' A' ' 130' ' ' ILE . 57.5 tp -58.98 -57.35 13.48 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.621 179.179 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.432 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.8 ptm180 -63.51 -45.05 92.4 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -173.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.6 m -64.79 -53.02 53.59 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 121.23 -0.188 . . . . 0.0 111.013 -177.842 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.66 -29.61 68.95 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.419 -0.513 . . . . 0.0 111.269 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.556 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 45.6 ttp180 -53.34 -53.52 49.9 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 120.805 0.336 . . . . 0.0 110.658 176.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -66.26 -43.71 85.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.936 -0.574 . . . . 0.0 110.69 -177.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -51.7 -52.24 49.76 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.395 -0.82 . . . . 0.0 112.241 176.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -71.38 -36.86 71.58 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.69 0.281 . . . . 0.0 110.728 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.556 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -49.83 -41.61 45.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.587 176.539 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -58.22 -28.57 64.97 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.956 -0.565 . . . . 0.0 111.723 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.7 m -103.05 -0.22 31.07 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.299 -0.409 . . . . 0.0 111.458 -172.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.776 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -75.58 -75.58 0.1 OUTLIER Pre-proline 0 CA--C 1.544 0.737 0 N-CA-C 113.587 0.958 . . . . 0.0 113.587 -173.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.776 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 77.7 Cg_endo -81.02 -23.82 5.12 Favored 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 121.389 1.392 . . . . 0.0 113.478 -167.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 56.2 -106.42 0.32 Allowed 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.738 -0.664 . . . . 0.0 111.881 179.458 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.566 ' O ' ' HB2' ' A' ' 65' ' ' GLU . 0.1 OUTLIER -110.98 -23.04 11.19 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.738 1.014 . . . . 0.0 113.738 -176.512 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.566 ' HB2' ' O ' ' A' ' 64' ' ' PHE . 29.7 mt-10 76.03 -172.6 0.1 Allowed 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.664 0.786 . . . . 0.0 109.8 -168.585 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.429 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . -146.51 -55.82 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.569 0 C-N-CA 119.664 -1.255 . . . . 0.0 114.375 -172.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.715 ' HB3' HG22 ' A' ' 70' ' ' ILE . 13.1 tpt180 -155.76 106.95 2.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.729 0.299 . . . . 0.0 110.385 -169.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.518 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 75.7 mmtt -63.76 -28.36 69.83 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.351 0.596 . . . . 0.0 109.708 174.373 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.571 ' HB2' ' HG3' ' A' ' 67' ' ' ARG . 18.1 mm-40 -59.63 -40.15 86.66 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.634 177.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.715 HG22 ' HB3' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -82.68 -23.63 8.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 CA-C-N 116.48 -0.327 . . . . 0.0 110.991 -178.586 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.67 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -48.71 -38.42 21.46 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.799 -177.258 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -52.6 -40.98 63.25 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 115.289 -0.868 . . . . 0.0 111.196 178.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.1 -32.91 59.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.266 0.555 . . . . 0.0 110.294 -176.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.505 HD22 ' SG ' ' A' ' 108' ' ' CYS . 32.4 mt -68.4 -43.72 76.62 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.488 -0.778 . . . . 0.0 110.929 -175.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.67 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.3 ptpt -74.56 -30.45 61.74 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.451 179.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.447 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.36 -35.68 73.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.967 0.413 . . . . 0.0 110.483 175.744 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.0 -45.09 75.06 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.352 176.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.607 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -50.04 -39.33 41.54 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.57 0.544 . . . . 0.0 110.805 171.088 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.447 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 71.3 t60 -60.9 -51.0 71.15 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.093 0.473 . . . . 0.0 110.473 -179.34 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.472 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.31 -50.03 69.45 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.774 178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 19.5 t80 -60.25 -37.23 79.75 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.433 -177.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -60.46 -32.04 71.02 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.081 0.467 . . . . 0.0 110.724 174.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.451 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 11.3 m -89.36 16.94 6.67 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.564 -0.744 . . . . 0.0 110.44 -179.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.451 ' HB2' ' O ' ' A' ' 83' ' ' SER . 52.3 m-80 77.5 3.55 3.09 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 123.831 0.852 . . . . 0.0 111.741 178.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.536 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 7.3 m-20 -80.24 84.68 5.87 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.615 0.722 . . . . 0.0 110.324 176.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.466 ' HD2' ' HG2' ' A' ' 33' ' ' LYS . 55.5 m80 -70.93 -43.24 68.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.972 178.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -63.75 -39.64 94.78 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.139 -176.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.536 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 12.1 mt -60.11 -49.0 79.37 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.795 0.331 . . . . 0.0 110.823 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.649 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -64.54 -34.16 77.58 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.127 -178.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -64.8 -44.64 89.27 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 120.723 0.297 . . . . 0.0 110.784 173.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.51 ' O ' ' HA3' ' A' ' 95' ' ' GLY . . . -67.63 -21.26 65.39 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.909 -177.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 54.5 mt -83.3 -61.62 1.71 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.433 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.649 HG12 ' O ' ' A' ' 89' ' ' ALA . 7.9 mm -56.46 -62.48 0.85 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 CA-C-N 116.483 -0.326 . . . . 0.0 111.517 -179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.616 ' OD1' ' HB3' ' A' ' 30' ' ' GLN . 3.5 m-20 -72.53 -14.59 61.68 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.358 -178.671 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.51 ' HA3' ' O ' ' A' ' 91' ' ' ALA . . . -74.13 -21.62 78.82 Favored Glycine 0 N--CA 1.443 -0.849 0 C-N-CA 120.855 -0.688 . . . . 0.0 112.174 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.525 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -83.01 -55.62 4.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.269 0.557 . . . . 0.0 110.647 -179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.525 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 4.5 t-20 156.31 -30.47 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 106.568 -1.641 . . . . 0.0 106.568 -176.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.968 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -54.24 137.05 15.53 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 112.936 -1.938 . . . . 0.0 110.947 175.522 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.55 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 11.2 p -144.57 174.14 11.21 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-O 121.324 0.583 . . . . 0.0 112.175 -175.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.766 HD11 ' O ' ' A' ' 107' ' ' GLU . 82.8 mt -145.73 137.31 12.94 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.108 -0.951 . . . . 0.0 110.463 176.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.496 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 73.8 Cg_endo -80.33 -6.94 13.91 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 121.312 1.341 . . . . 0.0 110.45 164.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 -80.79 -59.65 2.6 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 114.955 -1.02 . . . . 0.0 111.893 178.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.782 ' HA2' ' HG3' ' A' ' 30' ' ' GLN . . . 95.19 40.74 4.19 Favored Glycine 0 N--CA 1.449 -0.438 0 C-N-CA 120.083 -1.055 . . . . 0.0 111.912 -172.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.401 ' H ' HD13 ' A' ' 100' ' ' LEU . . . -115.77 153.4 31.48 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.323 0.582 . . . . 0.0 111.476 -177.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.607 HD11 ' HA ' ' A' ' 78' ' ' ALA . 2.0 tm? -91.25 -16.44 27.6 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 63.4 p -91.91 9.68 31.96 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-N 114.396 -1.275 . . . . 0.0 110.947 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.766 ' O ' HD11 ' A' ' 100' ' ' LEU . 27.6 mt-10 -145.59 151.96 38.93 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 175.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.505 ' SG ' HD22 ' A' ' 74' ' ' LEU . 94.4 m -155.86 138.73 15.3 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 173.385 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 16.5 m-30 -115.73 123.06 47.33 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 121.717 0.77 . . . . 0.0 110.09 175.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.968 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.8 t70 -91.75 152.67 20.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.247 -1.342 . . . . 0.0 110.307 -174.269 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -61.5 -23.43 65.91 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.551 -0.75 . . . . 0.0 112.244 -171.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.426 ' HB2' ' ND2' ' A' ' 114' ' ' ASN . 21.4 mt -78.83 1.83 22.04 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.959 0.409 . . . . 0.0 111.014 -178.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.67 26.81 12.4 Favored Glycine 0 N--CA 1.451 -0.366 0 N-CA-C 111.189 -0.764 . . . . 0.0 111.189 179.29 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.957 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 90.2 m-20 -101.98 155.27 18.27 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.361 -0.42 . . . . 0.0 110.888 -173.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 13.5 ptt180 -138.52 137.46 37.11 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.084 0.469 . . . . 0.0 110.609 176.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . 0.5 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 13.0 m-85 -117.76 132.45 56.46 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.437 177.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.417 ' HG3' ' O ' ' A' ' 61' ' ' ALA . 6.2 mm-40 -123.86 121.36 35.17 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 -176.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 33.9 tp -103.75 120.59 50.94 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -169.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.583 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 21.2 Cg_exo -71.38 156.42 58.64 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 123.869 3.046 . . . . 0.0 112.79 175.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.071 HG22 ' HE1' ' A' ' 39' ' ' TRP . 21.1 m -67.72 -18.75 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.896 -172.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.583 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 3.9 p90 -61.01 -18.13 56.04 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.843 0.354 . . . . 0.0 111.546 -170.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 42.9 t -103.44 -0.56 29.82 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.436 -176.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 64.5 mt -137.08 -54.35 0.7 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.543 0.572 . . . . 0.0 112.543 -175.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.483 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -135.11 119.34 13.4 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.517 -170.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 68.7 Cg_endo -101.48 21.64 0.19 Allowed 'Trans proline' 0 CA--C 1.558 1.69 0 C-N-CA 122.945 2.43 . . . . 0.0 117.002 178.354 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.483 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 41.9 Cg_endo -70.04 -34.49 13.56 Favored 'Trans proline' 0 C--N 1.367 1.534 0 CA-C-N 122.339 1.871 . . . . 0.0 111.897 175.471 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.82 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -81.61 51.14 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-O 121.56 0.695 . . . . 0.0 110.852 179.114 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -121.72 -42.03 2.44 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.24 179.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 3.0 tpt -94.59 -49.77 5.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.883 0.373 . . . . 0.0 110.411 179.022 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.505 HG12 HD22 ' A' ' 50' ' ' LEU . 17.0 mm 72.5 -73.62 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.38 0 CA-C-N 115.474 -0.784 . . . . 0.0 111.595 176.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.441 ' HA ' HG13 ' A' ' 136' ' ' ILE . 3.3 pt-20 -76.23 71.16 2.93 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.919 -174.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -90.44 179.74 5.79 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.466 172.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.494 ' HE2' ' O ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -85.43 29.7 0.66 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.289 0.566 . . . . 0.0 110.853 -178.652 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 4.0 p -80.49 -17.28 52.11 Favored 'General case' 0 N--CA 1.443 -0.797 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.33 171.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -162.95 -48.3 0.04 OUTLIER 'General case' 0 CA--C 1.52 -0.204 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.986 176.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.441 HG13 ' HA ' ' A' ' 131' ' ' GLU . 19.0 mm -66.68 138.25 23.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-O 121.174 0.511 . . . . 0.0 111.632 -175.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -139.5 -55.88 0.58 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.591 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 37.8 m -151.33 102.28 2.9 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.622 -177.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.844 HD22 HG21 ' A' ' 46' ' ' THR . 27.4 tp -87.44 78.35 8.67 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.209 0.528 . . . . 0.0 109.625 174.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -100.7 -27.99 13.08 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.983 -0.553 . . . . 0.0 109.998 179.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 3.7 pt . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.868 178.377 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.477 0.895 0 CA-C-O 120.798 0.332 . . . . 0.0 110.521 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.401 HD13 ' HA ' ' A' ' 15' ' ' LEU . 3.4 mm? -126.17 122.6 36.11 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.892 0.377 . . . . 0.0 110.971 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -91.15 91.3 8.18 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 171.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.468 ' HA ' ' OE1' ' A' ' 17' ' ' GLU . 0.0 OUTLIER -63.81 153.57 36.2 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.688 0.756 . . . . 0.0 112.107 -174.725 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -96.05 27.31 3.68 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.727 -177.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.8 m -79.9 46.44 0.79 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.188 -179.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.517 ' HG2' HG23 ' A' ' 22' ' ' THR . 40.1 tt0 70.66 -60.07 0.51 Allowed 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 123.504 0.722 . . . . 0.0 111.59 177.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.425 ' HA2' ' O ' ' A' ' 24' ' ' VAL . . . 86.66 39.02 7.83 Favored Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.589 -0.815 . . . . 0.0 113.126 177.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.517 HG23 ' HG2' ' A' ' 20' ' ' GLU . 28.0 p -102.03 54.29 0.8 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.448 0.642 . . . . 0.0 109.999 175.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.96 23.13 23.7 Favored Glycine 0 N--CA 1.446 -0.634 0 N-CA-C 110.44 -1.064 . . . . 0.0 110.44 -171.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.425 ' O ' ' HA2' ' A' ' 21' ' ' GLY . 96.4 t -140.19 110.32 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -175.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.71 -79.45 0.24 Allowed 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.91 -0.587 . . . . 0.0 110.866 -178.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mp -75.78 -60.86 2.13 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 122.069 0.937 . . . . 0.0 109.469 175.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.609 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 160.62 100.31 0.16 Allowed Glycine 0 N--CA 1.44 -1.093 0 CA-C-N 114.098 -1.41 . . . . 0.0 110.886 -178.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.684 ' O ' ' HB ' ' A' ' 99' ' ' THR . 0.0 OUTLIER -56.62 -32.74 65.6 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.924 0.392 . . . . 0.0 111.385 179.827 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.601 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 30.8 p-10 -108.91 158.7 17.44 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 170.062 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -80.27 111.32 21.38 Favored Pre-proline 0 C--N 1.324 -0.516 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 -162.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.671 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 4.8 Cg_exo -79.71 -164.57 0.29 Allowed 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.743 2.962 . . . . 0.0 109.972 166.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.552 ' O ' ' HG2' ' A' ' 34' ' ' LYS . 28.4 tp -52.74 132.06 35.82 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.103 -0.332 . . . . 0.0 110.103 176.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.537 ' HE3' ' CZ ' ' A' ' 81' ' ' PHE . 0.0 OUTLIER -57.25 109.53 0.68 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.361 0.6 . . . . 0.0 111.319 -175.656 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.877 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 10.8 mmpt? -97.55 -19.86 18.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.053 -175.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -113.19 170.07 8.48 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.493 0.664 . . . . 0.0 111.605 179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 8.7 pttt -109.38 159.85 29.87 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.04 -177.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.732 ' HB2' HG12 ' A' ' 120' ' ' VAL . 33.1 Cg_exo -51.29 128.73 26.39 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.567 2.178 . . . . 0.0 112.294 -175.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.486 ' HE2' ' HB3' ' A' ' 38' ' ' LYS . 24.3 ttpt -113.46 123.21 49.5 Favored 'General case' 0 N--CA 1.442 -0.849 0 CA-C-N 115.489 -0.778 . . . . 0.0 112.253 -170.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 1.02 ' HE1' HG22 ' A' ' 120' ' ' VAL . 3.1 p-90 -176.3 25.17 0.0 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-N 114.666 -1.152 . . . . 0.0 109.441 172.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.429 ' HE2' HG21 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -157.59 166.02 34.01 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.979 -167.309 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 52.1 m -69.37 128.75 37.66 Favored 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 165.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -76.92 -18.31 58.37 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . 0.519 ' CE2' ' HG2' ' A' ' 45' ' ' MET . 51.2 t80 -133.34 75.0 71.05 Favored Pre-proline 0 C--N 1.325 -0.481 0 CA-C-N 115.325 -0.852 . . . . 0.0 109.215 170.153 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.757 ' HG2' HG12 ' A' ' 130' ' ' ILE . 50.4 Cg_exo -62.45 -26.36 76.47 Favored 'Trans proline' 0 CA--C 1.508 -0.809 0 C-N-CA 123.853 3.035 . . . . 0.0 113.549 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.519 ' HG2' ' CE2' ' A' ' 43' ' ' TYR . 54.1 mtt 78.18 -82.64 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.235 0 CA-C-N 113.696 -1.593 . . . . 0.0 110.797 -177.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.626 ' HA ' ' HG2' ' A' ' 131' ' ' GLU . 67.3 p -115.69 175.85 5.34 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.352 -0.385 . . . . 0.0 111.102 -177.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.604 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 0.8 OUTLIER -68.12 -36.7 80.14 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.432 0.158 . . . . 0.0 110.618 -177.966 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -58.08 -41.94 94.83 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 121.167 -0.54 . . . . 0.0 111.863 -179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.76 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -74.46 -38.49 62.93 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 110.141 -0.318 . . . . 0.0 110.141 177.516 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.597 HD22 HD13 ' A' ' 130' ' ' ILE . 59.8 tp -54.48 -54.34 42.28 Favored 'General case' 0 C--N 1.327 -0.4 0 O-C-N 123.299 0.375 . . . . 0.0 111.15 178.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.604 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 14.9 ptm180 -64.51 -47.1 80.15 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.323 -179.056 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.1 t -60.64 -45.35 94.38 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.684 -178.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.482 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 65.5 mmtt -72.72 -30.09 63.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.495 179.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 13.2 ttp180 -57.94 -41.32 82.54 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 177.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -70.55 -50.64 35.35 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-O 121.438 0.637 . . . . 0.0 110.745 178.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -54.91 -46.85 74.9 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.633 -179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.482 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 34.0 m-85 -70.48 -36.43 73.85 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.467 179.174 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.01 -30.58 48.0 Favored 'General case' 0 C--N 1.328 -0.351 0 O-C-N 123.388 0.43 . . . . 0.0 111.223 176.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -60.62 -34.25 73.98 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.937 0.399 . . . . 0.0 112.074 173.69 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 23.2 m -100.0 -27.1 13.74 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.977 -171.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.506 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -52.1 -52.93 57.48 Favored Pre-proline 0 CA--C 1.542 0.662 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 -175.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.506 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 49.4 Cg_endo -84.48 -7.18 9.85 Favored 'Trans proline' 0 C--N 1.348 0.525 0 C-N-CA 122.166 1.911 . . . . 0.0 112.877 -177.16 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 61.86 -116.31 0.6 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-N 115.783 -0.644 . . . . 0.0 111.398 -176.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.489 ' O ' ' HG2' ' A' ' 65' ' ' GLU . 22.7 m-85 -109.37 -47.08 3.45 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-O 121.225 0.536 . . . . 0.0 110.684 -179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 64' ' ' PHE . 55.2 mm-40 -163.23 177.63 8.87 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 114.715 -1.13 . . . . 0.0 109.21 -178.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.492 ' HA2' ' OD1' ' A' ' 114' ' ' ASN . . . -133.34 141.84 13.27 Favored Glycine 0 N--CA 1.432 -1.609 0 CA-C-N 115.414 -0.812 . . . . 0.0 111.347 173.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.664 ' O ' HG22 ' A' ' 70' ' ' ILE . 33.7 mmt180 -66.51 94.72 0.29 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 171.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.421 ' HA ' ' HD2' ' A' ' 68' ' ' LYS . 15.1 tptm -50.85 -37.11 41.29 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.578 -0.737 . . . . 0.0 112.793 -171.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -58.41 -33.43 69.66 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.664 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -82.77 -22.52 8.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 C-N-CA 120.731 -0.388 . . . . 0.0 111.229 -178.618 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.626 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.1 OUTLIER -50.62 -37.2 38.97 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.808 -173.285 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -59.24 -34.24 71.97 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.326 179.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.22 -29.01 42.58 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.02 0.438 . . . . 0.0 110.091 -178.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.605 HD21 HD13 ' A' ' 70' ' ' ILE . 34.2 mt -67.96 -49.27 62.71 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.467 -179.568 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.4 ptpt -69.01 -28.99 67.08 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.708 178.043 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.446 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.74 -38.72 76.92 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.179 176.609 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.402 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -67.95 -51.35 48.54 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 121.124 -0.23 . . . . 0.0 110.618 178.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -51.54 -34.13 35.15 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.038 172.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.446 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 28.5 t60 -64.18 -47.55 79.38 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.133 0.492 . . . . 0.0 109.81 179.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.46 ' HB1' ' HB2' ' A' ' 88' ' ' LEU . . . -68.85 -53.46 21.22 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.731 179.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.537 ' CZ ' ' HE3' ' A' ' 33' ' ' LYS . 12.7 t80 -54.44 -28.5 44.55 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.802 177.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -63.17 -28.82 70.32 Favored 'General case' 0 N--CA 1.467 0.384 0 O-C-N 121.591 -0.693 . . . . 0.0 111.229 174.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.7 t -92.15 15.26 13.91 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.469 0.652 . . . . 0.0 109.455 175.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 57.4 t30 70.71 7.44 6.22 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 114.685 -1.143 . . . . 0.0 111.012 -178.279 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.435 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 4.7 m-20 -73.84 82.05 1.64 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.199 0.524 . . . . 0.0 110.441 176.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 46.2 t-80 -72.09 -37.25 69.61 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.907 -0.588 . . . . 0.0 109.458 174.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.42 ' HG3' ' N ' ' A' ' 88' ' ' LEU . 10.2 pt-20 -53.67 -43.7 69.07 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.699 178.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.482 ' O ' HG13 ' A' ' 92' ' ' ILE . 14.5 mt -65.65 -51.93 55.66 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.981 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.573 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -63.27 -40.11 96.47 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.92 -176.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.6 pt20 -66.17 -38.78 88.91 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.772 0.32 . . . . 0.0 110.195 179.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -71.55 -21.0 61.95 Favored 'General case' 0 N--CA 1.455 -0.198 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.666 -179.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.3 mt -81.84 -60.68 2.08 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.861 177.051 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.573 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -52.66 -61.81 0.73 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.327 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.416 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -67.26 -25.25 65.98 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.564 -177.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -75.24 -12.61 83.41 Favored Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.633 -0.794 . . . . 0.0 111.951 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -102.07 6.63 41.09 Favored 'General case' 0 N--CA 1.453 -0.302 0 O-C-N 122.987 -0.126 . . . . 0.0 110.881 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 63.8 t30 74.14 8.11 4.69 Favored 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.982 0.896 . . . . 0.0 109.525 -179.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.934 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -90.51 138.2 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.663 0 CA-C-N 114.96 -1.018 . . . . 0.0 109.348 176.656 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.684 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 19.8 p -123.19 164.79 18.03 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.362 -177.038 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.851 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.6 tm? -150.42 104.11 3.11 Favored Pre-proline 0 C--N 1.326 -0.414 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.483 178.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.713 ' HD2' HD22 ' A' ' 100' ' ' LEU . 67.4 Cg_endo -71.62 -7.9 22.12 Favored 'Trans proline' 0 N--CA 1.476 0.475 0 C-N-CA 123.325 2.684 . . . . 0.0 114.216 -173.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.635 ' H ' HD13 ' A' ' 100' ' ' LEU . 29.7 m-70 -82.72 -15.45 51.84 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 120.575 0.226 . . . . 0.0 111.265 177.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.671 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 68.77 37.67 84.51 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.275 -176.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.851 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -135.36 152.76 51.75 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-O 121.267 0.556 . . . . 0.0 111.572 -175.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.476 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.6 tm? -79.55 -21.92 44.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.279 178.549 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 118' ' ' LEU . 37.7 p -87.7 24.09 1.81 Allowed 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.091 -0.959 . . . . 0.0 112.242 -173.827 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.686 ' HB3' HD21 ' A' ' 100' ' ' LEU . 32.5 mt-10 -156.07 149.56 24.76 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 173.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.44 ' SG ' HD22 ' A' ' 74' ' ' LEU . 74.8 m -151.31 139.44 20.16 Favored 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 120.992 -0.283 . . . . 0.0 111.04 178.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.484 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 12.5 m-30 -118.72 121.59 40.46 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 116.214 -0.448 . . . . 0.0 109.89 176.412 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.934 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.0 OUTLIER -84.5 145.12 28.28 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.106 178.915 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -58.6 -31.81 68.4 Favored 'General case' 0 C--O 1.234 0.287 0 O-C-N 124.649 1.218 . . . . 0.0 111.835 -171.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 16.8 mt -69.36 -40.5 77.46 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.568 -177.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 141.75 43.6 0.06 OUTLIER Glycine 0 N--CA 1.444 -0.771 0 CA-C-N 115.184 -0.917 . . . . 0.0 111.766 177.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.875 ' HB3' ' HB3' ' A' ' 110' ' ' ASP . 1.8 t-20 -109.14 152.49 25.04 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.949 -0.3 . . . . 0.0 110.287 -178.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.484 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 38.6 ttp180 -134.73 128.03 32.12 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.785 0.326 . . . . 0.0 110.31 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -117.37 137.97 52.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 116.003 -0.544 . . . . 0.0 109.808 177.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 8.4 mm-40 -122.29 119.45 31.18 Favored 'General case' 0 C--N 1.317 -0.814 0 N-CA-C 107.68 -1.23 . . . . 0.0 107.68 176.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.502 ' HB2' ' O ' ' A' ' 106' ' ' THR . 4.0 mm? -95.53 115.34 65.4 Favored Pre-proline 0 C--N 1.323 -0.57 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -170.384 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.561 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 33.7 Cg_exo -69.21 155.2 68.46 Favored 'Trans proline' 0 CA--C 1.533 0.428 0 C-N-CA 124.169 3.246 . . . . 0.0 113.622 178.551 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.02 HG22 ' HE1' ' A' ' 39' ' ' TRP . 11.1 m -72.69 -23.02 20.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-N 114.75 -1.114 . . . . 0.0 112.631 -171.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.561 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.6 p90 -55.95 -29.69 60.55 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 112.814 0.672 . . . . 0.0 112.814 -168.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 53.6 t -99.32 -1.71 38.23 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.598 0.237 . . . . 0.0 111.34 -175.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 96.3 mt -133.85 -71.38 0.51 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.618 -0.433 . . . . 0.0 111.975 -174.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.701 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -118.76 116.06 34.83 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.606 -170.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.419 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 83.0 Cg_endo -104.16 32.61 0.06 OUTLIER 'Trans proline' 0 CA--C 1.556 1.582 0 C-N-CA 123.045 2.497 . . . . 0.0 116.539 177.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -74.73 -19.61 18.37 Favored 'Trans proline' 0 C--N 1.367 1.506 0 CA-C-N 121.945 1.73 . . . . 0.0 111.68 172.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.666 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -90.91 52.74 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 121.471 0.653 . . . . 0.0 109.921 176.495 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -112.27 -56.63 2.37 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.297 -177.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 41.4 ttp -104.35 89.66 3.31 Favored 'General case' 0 N--CA 1.448 -0.544 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 175.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.757 HG12 ' HG2' ' A' ' 44' ' ' PRO . 3.4 mp -75.59 -52.09 19.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.833 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.246 -178.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.626 ' HG2' ' HA ' ' A' ' 46' ' ' THR . 7.5 mt-10 -62.56 100.62 0.2 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.437 177.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.77 -106.0 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.032 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -76.23 -69.46 0.5 Allowed 'General case' 0 C--N 1.309 -1.164 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 173.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 9.3 t 38.24 -108.88 0.07 Allowed 'General case' 0 CA--C 1.535 0.374 0 O-C-N 123.955 0.785 . . . . 0.0 111.984 179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 63.3 m-20 -115.94 -8.24 11.91 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 121.196 0.522 . . . . 0.0 111.236 177.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 46.7 mm -55.62 139.87 14.3 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.829 0 CA-C-N 115.215 -0.902 . . . . 0.0 111.942 -178.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER 44.76 42.0 5.55 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 115.427 -0.806 . . . . 0.0 112.22 -175.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 24.6 m -133.65 126.76 31.54 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.783 0.325 . . . . 0.0 110.626 179.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.8 tp -142.3 44.4 1.65 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.843 0.83 . . . . 0.0 110.322 177.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 30.4 m-20 -122.59 10.97 9.79 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.111 -0.95 . . . . 0.0 108.725 175.178 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 2.6 pt . . . . . 0 C--O 1.247 0.954 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.12 -174.318 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 28.8 m . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -98.88 39.55 1.26 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.214 0.53 . . . . 0.0 110.158 178.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -122.94 33.17 5.48 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-O 121.303 0.573 . . . . 0.0 110.197 -176.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -87.93 52.77 2.56 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.581 -0.736 . . . . 0.0 109.991 -174.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -82.73 15.41 2.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.914 -173.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 23.4 m -116.7 7.37 13.48 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-O 121.316 0.579 . . . . 0.0 109.77 175.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.562 ' HA ' ' H ' ' A' ' 24' ' ' VAL . 26.6 tt0 -78.35 12.9 1.72 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.249 -173.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -59.07 -33.75 75.99 Favored Glycine 0 C--N 1.331 0.271 0 N-CA-C 111.23 -0.748 . . . . 0.0 111.23 173.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.8 t -111.22 23.12 14.44 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 121.328 0.585 . . . . 0.0 109.674 175.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 62.0 50.66 63.32 Favored Glycine 0 N--CA 1.451 -0.312 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.765 -179.674 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.859 HG22 ' HG3' ' A' ' 28' ' ' ARG . 25.4 t -143.07 118.65 4.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.593 0 CA-C-O 121.143 0.497 . . . . 0.0 109.791 -177.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -73.37 -70.11 0.39 Allowed 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.795 179.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.638 HD13 ' H ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -115.54 -18.21 10.99 Favored 'General case' 0 C--N 1.327 -0.38 0 C-N-CA 120.613 -0.435 . . . . 0.0 111.887 -178.678 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.766 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 141.78 87.02 0.1 Allowed Glycine 0 C--O 1.222 -0.627 0 C-N-CA 120.397 -0.906 . . . . 0.0 112.771 176.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.859 ' HG3' HG22 ' A' ' 24' ' ' VAL . 8.8 mtt180 -62.24 -30.69 71.28 Favored 'General case' 0 CA--C 1.519 -0.217 0 N-CA-C 112.657 0.614 . . . . 0.0 112.657 179.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.564 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 8.7 p30 -109.67 161.51 15.32 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 -176.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.606 ' HA ' ' HA2' ' A' ' 103' ' ' GLY . 26.2 tt0 -79.67 109.27 11.25 Favored Pre-proline 0 CA--C 1.534 0.331 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 -165.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.939 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 73.2 Cg_endo -76.63 -165.29 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 123.335 2.69 . . . . 0.0 111.425 171.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.649 HD23 ' HE3' ' A' ' 34' ' ' LYS . 17.9 tp -48.33 138.06 10.38 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.189 0.518 . . . . 0.0 111.119 178.043 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.831 ' HG2' ' HB2' ' A' ' 105' ' ' LEU . 0.4 OUTLIER -76.9 94.15 3.88 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.874 -172.136 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.649 ' HE3' HD23 ' A' ' 32' ' ' LEU . 32.8 mmtp -98.68 -42.28 7.31 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 112.457 0.54 . . . . 0.0 112.457 -176.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.479 ' HG2' ' HZ3' ' A' ' 38' ' ' LYS . 9.4 tp10 -68.66 156.45 38.16 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.638 0.732 . . . . 0.0 112.543 -169.896 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.491 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 35.7 mmtm -95.08 160.93 29.82 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 114.565 -1.198 . . . . 0.0 109.251 -179.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.774 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 20.6 Cg_exo -66.44 138.37 50.2 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.239 1.959 . . . . 0.0 112.41 179.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.704 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 3.7 mtmt -110.76 148.98 31.2 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.847 -174.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 1.029 ' HE1' HG22 ' A' ' 120' ' ' VAL . 0.8 OUTLIER 125.64 -4.52 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.105 0 O-C-N 126.047 2.092 . . . . 0.0 108.945 -171.186 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.543 ' HD2' ' O ' ' A' ' 41' ' ' SER . 0.0 OUTLIER -115.94 151.9 34.5 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.563 -167.466 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.543 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 58.4 m -64.98 149.08 50.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.456 -179.743 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.0 m-20 -56.81 -50.57 71.98 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 172.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 74.2 t80 -139.22 102.6 7.38 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 114.551 -1.204 . . . . 0.0 109.548 171.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.524 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 15.0 Cg_exo -67.88 131.63 24.53 Favored 'Trans proline' 0 N--CA 1.452 -0.912 0 C-N-CA 122.077 1.851 . . . . 0.0 109.828 172.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.76 -81.3 0.33 Allowed 'General case' 0 C--N 1.321 -0.664 0 C-N-CA 120.805 -0.358 . . . . 0.0 110.742 -175.417 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.604 ' HB ' HG21 ' A' ' 136' ' ' ILE . 43.1 p -115.17 -175.52 2.71 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.894 178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.502 ' HB2' ' OE2' ' A' ' 131' ' ' GLU . 9.0 t70 -68.13 -36.53 79.85 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.788 0.328 . . . . 0.0 111.133 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.543 ' O ' ' HG2' ' A' ' 51' ' ' ARG . . . -63.07 -42.14 99.64 Favored Glycine 0 C--N 1.33 0.238 0 C-N-CA 120.99 -0.624 . . . . 0.0 111.881 179.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 26.4 mm-40 -68.16 -37.7 81.3 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.401 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 1.4 tt -59.47 -55.33 35.97 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.029 178.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.543 ' HG2' ' O ' ' A' ' 48' ' ' GLY . 5.9 ptp180 -58.7 -46.99 86.07 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.754 0.311 . . . . 0.0 111.756 -176.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.47 ' O ' ' HG3' ' A' ' 56' ' ' GLU . 74.2 m -67.35 -52.06 44.78 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.716 -0.22 . . . . 0.0 111.171 -178.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 4.9 mptp? -66.64 -32.67 74.15 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.242 -179.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.419 HH11 ' HD3' ' A' ' 54' ' ' ARG . 11.0 ttm180 -55.41 -48.29 74.6 Favored 'General case' 0 CA--C 1.517 -0.298 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 176.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -64.22 -47.99 77.56 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 115.611 -0.722 . . . . 0.0 110.654 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.47 ' HG3' ' O ' ' A' ' 52' ' ' SER . 59.8 mt-10 -52.64 -48.47 66.39 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 115.805 -0.634 . . . . 0.0 110.762 177.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -66.1 -40.33 90.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.574 178.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.449 ' HA ' ' HB3' ' A' ' 61' ' ' ALA . 7.1 m95 -54.1 -31.36 51.81 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 112.265 0.468 . . . . 0.0 112.265 177.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -66.96 -19.07 65.66 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.855 0.359 . . . . 0.0 111.27 176.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 14.8 m -108.27 -16.46 14.24 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.603 0.716 . . . . 0.0 110.224 178.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.844 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -76.88 169.61 20.34 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.303 -178.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.844 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 36.0 Cg_endo -60.1 -50.78 6.71 Favored 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.546 2.164 . . . . 0.0 113.069 -176.259 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 55.42 -107.44 0.38 Allowed 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.833 -177.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -108.7 -12.13 14.98 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 111.628 0.233 . . . . 0.0 111.628 -175.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 -74.82 152.18 38.99 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.214 0.53 . . . . 0.0 111.899 -171.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 115.0 -127.89 7.87 Favored Glycine 0 N--CA 1.444 -0.806 0 CA-C-N 115.559 -0.746 . . . . 0.0 112.722 176.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.614 ' HB2' HG22 ' A' ' 70' ' ' ILE . 5.3 mmp_? -143.36 126.62 16.61 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 122.72 0.408 . . . . 0.0 109.992 -176.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.3 mmtp -71.02 -26.82 63.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.084 0.469 . . . . 0.0 110.072 176.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.402 ' OE2' ' HD3' ' A' ' 67' ' ' ARG . 2.3 mp0 -60.53 -43.1 97.53 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.945 179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.844 HD12 ' HB2' ' A' ' 110' ' ' ASP . 0.0 OUTLIER -80.8 -23.42 10.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.37 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.189 -176.637 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.558 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 2.0 m95 -52.5 -37.11 56.62 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -177.33 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -58.11 -35.36 71.33 Favored 'General case' 0 C--N 1.326 -0.439 0 O-C-N 123.278 0.361 . . . . 0.0 111.08 -177.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -76.25 -29.85 57.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.108 0.48 . . . . 0.0 110.555 -178.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.504 HD21 ' CD1' ' A' ' 70' ' ' ILE . 16.8 mt -67.72 -53.4 27.79 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.185 -178.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.558 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 12.7 ptpt -65.13 -30.42 71.35 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.898 178.856 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -69.84 -36.97 76.01 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.651 -0.249 . . . . 0.0 111.103 177.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -69.08 -50.38 48.86 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-O 120.601 0.239 . . . . 0.0 110.438 178.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . -55.12 -31.92 61.65 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 174.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.419 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 24.5 t60 -63.78 -47.37 81.2 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.01 0.433 . . . . 0.0 109.846 179.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.463 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -70.99 -52.37 20.07 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.604 -0.726 . . . . 0.0 110.827 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.568 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 21.0 t80 -57.28 -35.14 69.42 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.486 -177.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -65.06 -27.13 68.57 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.943 0.401 . . . . 0.0 111.322 177.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -94.97 22.11 6.91 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.28 177.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 13.6 m120 77.02 0.96 3.14 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.914 0.886 . . . . 0.0 111.648 177.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.777 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 2.0 m-20 -77.46 84.37 3.86 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.321 0.581 . . . . 0.0 110.705 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 33' ' ' LYS . 60.0 m80 -71.92 -39.68 69.32 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.947 178.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.529 ' HA ' ' NE2' ' A' ' 90' ' ' GLN . 11.5 pt-20 -69.82 -37.71 76.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.385 -177.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.777 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 0.8 OUTLIER -62.99 -51.22 67.67 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.931 0.396 . . . . 0.0 110.768 -179.846 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.806 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -62.34 -46.43 88.74 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.576 -175.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.529 ' NE2' ' HA ' ' A' ' 87' ' ' GLU . 10.7 pt20 -63.79 -34.46 77.96 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-O 120.59 0.233 . . . . 0.0 110.528 179.345 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -72.17 -26.61 62.15 Favored 'General case' 0 CA--C 1.52 -0.194 0 CA-C-O 120.918 0.39 . . . . 0.0 110.557 178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 88' ' ' LEU . 53.8 mt -72.01 -47.06 56.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.511 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.088 174.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.649 HG23 HG22 ' A' ' 98' ' ' ILE . 9.7 mm -49.8 -61.83 0.56 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.19 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.529 173.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -64.06 -34.27 77.64 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.166 -179.228 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -65.56 -23.9 70.71 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.44 -178.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.528 ' HB3' HD12 ' A' ' 98' ' ' ILE . . . -99.97 9.27 43.2 Favored 'General case' 0 N--CA 1.446 -0.66 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.154 -178.023 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 62.6 t30 69.85 11.93 7.85 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 122.83 1.3 . . . . 0.0 108.882 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.649 HG22 HG23 ' A' ' 93' ' ' ILE . 51.2 mt -83.88 141.0 15.36 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.806 0 CA-C-N 113.343 -1.753 . . . . 0.0 109.626 179.065 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.641 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 30.0 p -134.5 168.6 18.66 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 120.208 -0.597 . . . . 0.0 112.101 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.536 HD21 ' C ' ' A' ' 107' ' ' GLU . 4.0 mt -150.2 106.5 3.17 Favored Pre-proline 0 N--CA 1.449 -0.506 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.05 177.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.766 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 24.9 Cg_endo -63.14 -26.36 72.89 Favored 'Trans proline' 0 N--CA 1.458 -0.569 0 C-N-CA 121.431 1.421 . . . . 0.0 110.574 171.116 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 39.2 m170 -77.23 -20.89 54.64 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 0.0 110.798 176.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.939 ' HA3' ' HD2' ' A' ' 31' ' ' PRO . . . 55.96 38.26 74.27 Favored Glycine 0 C--N 1.333 0.403 0 CA-C-N 114.819 -1.082 . . . . 0.0 114.18 179.748 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.434 ' O ' HD13 ' A' ' 100' ' ' LEU . . . -110.93 149.21 30.97 Favored 'General case' 0 C--N 1.316 -0.871 0 CA-C-O 120.756 0.313 . . . . 0.0 110.978 -177.019 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.831 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 0.3 OUTLIER -78.84 -24.41 44.41 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 173.909 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.774 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 47.4 p -85.21 26.82 0.85 Allowed 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.583 -178.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.536 ' C ' HD21 ' A' ' 100' ' ' LEU . 20.1 mt-10 -165.48 156.98 14.44 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 114.817 -1.083 . . . . 0.0 108.261 175.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.507 ' HA ' HD21 ' A' ' 100' ' ' LEU . 86.9 m -156.22 139.86 15.99 Favored 'General case' 0 C--N 1.319 -0.749 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 172.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.525 ' CD2' ' HD2' ' A' ' 101' ' ' PRO . 18.3 m-30 -116.87 121.98 43.04 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-O 121.972 0.891 . . . . 0.0 110.266 176.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.879 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 3.5 t70 -80.48 149.07 30.19 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 113.948 -1.478 . . . . 0.0 110.249 -177.518 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -59.66 -25.97 65.16 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.933 -1.03 . . . . 0.0 112.714 -168.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 36.7 mt -74.8 -9.6 58.71 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.208 0.528 . . . . 0.0 110.642 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.16 26.04 6.17 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.95 -178.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.879 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 64.5 m-80 -94.73 150.24 20.41 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 110.067 -0.345 . . . . 0.0 110.067 -179.033 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.425 ' HA ' ' HD1' ' A' ' 109' ' ' TYR . 10.3 ptp180 -123.37 144.69 49.3 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.045 0.45 . . . . 0.0 109.881 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 26.6 m-85 -136.01 142.45 44.47 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.155 174.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.506 ' HA ' ' HG2' ' A' ' 107' ' ' GLU . 45.7 mt-30 -122.31 119.9 32.49 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 175.403 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.403 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 0.2 OUTLIER -85.67 112.5 45.13 Favored Pre-proline 0 C--N 1.317 -0.84 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.45 -171.658 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.556 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 37.0 Cg_exo -69.16 154.71 69.68 Favored 'Trans proline' 0 CA--C 1.532 0.418 0 C-N-CA 123.586 2.857 . . . . 0.0 113.404 -178.386 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.029 HG22 ' HE1' ' A' ' 39' ' ' TRP . 32.6 m -61.52 -16.82 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.454 0 CA-C-N 114.881 -1.054 . . . . 0.0 112.94 -174.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.556 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.7 p90 -59.24 -21.02 58.91 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 112.67 0.618 . . . . 0.0 112.67 -169.07 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 20.6 t -126.88 14.44 7.42 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.013 0.435 . . . . 0.0 110.688 -178.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.706 HD13 HG22 ' A' ' 106' ' ' THR . 65.7 mt -132.54 -53.04 0.94 Allowed 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 120.949 0.404 . . . . 0.0 111.902 -176.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.582 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -128.05 114.88 20.33 Favored Pre-proline 0 C--N 1.321 -0.648 0 CA-C-O 120.712 0.291 . . . . 0.0 110.953 -173.395 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.434 ' N ' ' CD ' ' A' ' 126' ' ' PRO . 75.6 Cg_endo -96.99 16.21 0.7 Allowed 'Trans proline' 0 CA--C 1.558 1.719 0 C-N-CA 123.012 2.475 . . . . 0.0 117.162 178.83 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.582 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 39.9 Cg_endo -68.66 -16.32 42.13 Favored 'Trans proline' 0 C--N 1.371 1.742 0 CA-C-N 122.486 1.924 . . . . 0.0 111.656 173.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.633 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -110.62 46.69 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.574 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.202 177.467 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -91.51 -36.75 13.56 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.875 -179.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . 0.435 ' HG3' ' O ' ' A' ' 131' ' ' GLU . 39.6 tpp -115.89 -43.32 3.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.952 -177.547 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 5.2 mp 69.17 -70.95 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 C-N-CA 123.254 0.622 . . . . 0.0 111.697 177.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.502 ' OE2' ' HB2' ' A' ' 47' ' ' ASP . 9.2 pt-20 -74.75 154.2 38.48 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.292 -178.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -87.91 164.97 15.58 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.569 0.581 . . . . 0.0 112.569 -177.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 19.5 ttpt 20.38 -89.03 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.682 0 O-C-N 125.356 1.66 . . . . 0.0 113.902 -174.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 20.9 t 179.36 81.77 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 108.96 -0.755 . . . . 0.0 108.96 -176.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -134.05 -41.02 0.83 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.989 -178.525 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.687 HG22 ' HG3' ' A' ' 137' ' ' GLU . 47.6 mm -36.06 -80.4 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 124.438 1.086 . . . . 0.0 113.607 -174.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.687 ' HG3' HG22 ' A' ' 136' ' ' ILE . 84.3 mt-10 -117.26 37.09 3.98 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.041 0.448 . . . . 0.0 110.67 177.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 19.3 m -82.69 78.07 9.36 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.018 177.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 22.0 tp -93.14 139.49 30.53 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.036 -179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -98.27 -28.55 13.64 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 120.83 0.348 . . . . 0.0 110.927 -175.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 141' ' ' ILE . 28.7 pt . . . . . 0 C--O 1.247 0.962 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.418 -178.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 50.6 m . . . . . 0 N--CA 1.478 0.969 0 CA-C-O 120.895 0.379 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -79.33 83.91 5.31 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 121.091 0.472 . . . . 0.0 111.005 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 50.1 t-20 -154.28 134.57 13.31 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 177.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -80.59 -19.34 45.74 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.828 0.347 . . . . 0.0 110.381 -179.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -84.48 152.39 23.99 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 175.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.9 p -79.11 46.18 0.69 Allowed 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -173.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.46 ' CG ' ' HB2' ' A' ' 25' ' ' ALA . 24.6 mm-40 64.98 116.02 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 123.205 0.602 . . . . 0.0 112.175 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.28 -15.1 81.35 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 176.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.2 p -62.51 -24.86 67.72 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.346 -0.427 . . . . 0.0 110.942 177.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 131.32 71.89 0.1 Allowed Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.625 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.0 t 73.52 125.26 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 CA-C-O 121.597 0.713 . . . . 0.0 112.321 174.563 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.46 ' HB2' ' CG ' ' A' ' 20' ' ' GLU . . . -103.73 -88.13 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.334 175.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.471 HD21 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -75.91 -16.0 60.1 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.002 -178.139 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.568 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 112.03 98.45 2.41 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.911 -0.661 . . . . 0.0 112.562 177.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.687 HH11 ' HB3' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -67.38 -27.15 66.86 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-O 121.426 0.631 . . . . 0.0 110.401 175.087 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.687 ' HB3' HH11 ' A' ' 28' ' ' ARG . 4.9 p-10 -97.28 160.33 14.39 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.269 -0.878 . . . . 0.0 108.753 178.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.7 tt0 -81.37 106.29 5.57 Favored Pre-proline 0 C--N 1.326 -0.431 0 O-C-N 123.589 0.555 . . . . 0.0 112.36 -169.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.704 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 91.4 Cg_endo -79.59 -164.99 0.31 Allowed 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 123.284 2.656 . . . . 0.0 111.222 172.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 11.2 mp -50.58 137.65 19.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.785 0.326 . . . . 0.0 110.757 178.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.721 ' HA ' ' O ' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -75.43 100.62 4.53 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.375 1.083 . . . . 0.0 111.201 -171.007 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -98.4 -19.14 17.89 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.228 -177.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.774 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 4.0 tp10 -95.67 149.26 21.67 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.091 0.472 . . . . 0.0 110.751 -174.168 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.2 mttt -98.73 161.47 24.91 Favored Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.617 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.662 ' HG3' HG21 ' A' ' 106' ' ' THR . 32.0 Cg_exo -55.58 142.23 81.98 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.617 2.211 . . . . 0.0 112.995 -177.286 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.644 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 36.2 ttpt -111.54 135.69 51.76 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.384 -170.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 1.043 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.4 p-90 152.01 -17.25 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.22 0 O-C-N 124.792 1.307 . . . . 0.0 110.961 179.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.474 ' HG2' HG13 ' A' ' 127' ' ' ILE . 0.0 OUTLIER -113.41 164.51 13.51 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-O 120.573 0.225 . . . . 0.0 110.881 -174.664 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 39.7 m -65.27 119.73 11.45 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.122 -0.49 . . . . 0.0 109.839 178.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 16.3 t0 -67.5 -28.76 68.11 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 63.4 t80 -126.18 89.77 51.56 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.369 167.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.596 ' HB2' HG13 ' A' ' 130' ' ' ILE . 3.4 Cg_exo -79.16 137.12 13.33 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.973 2.449 . . . . 0.0 112.262 177.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.42 ' HB3' ' H ' ' A' ' 46' ' ' THR . 12.4 mmm -108.03 -137.64 0.37 Allowed 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 174.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.42 ' H ' ' HB3' ' A' ' 45' ' ' MET . 47.5 p -81.03 -175.19 5.28 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.783 -177.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.488 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 21.0 t70 -56.69 -49.58 74.69 Favored 'General case' 0 N--CA 1.467 0.423 0 N-CA-C 113.335 0.865 . . . . 0.0 113.335 -168.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -61.07 -36.14 91.85 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.827 -0.701 . . . . 0.0 112.706 -178.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 18.7 mm-40 -72.37 -44.17 62.95 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.033 0.444 . . . . 0.0 110.263 175.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.458 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 50.6 tp -60.3 -45.52 93.09 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.807 -178.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.488 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 12.4 ptp180 -64.68 -50.84 65.42 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 120.707 0.289 . . . . 0.0 110.941 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.463 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 26.7 t -64.07 -57.38 9.81 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.693 -176.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 57' ' ' PHE . 2.0 tppt? -63.99 -28.05 69.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.138 -174.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 40.5 ttm180 -58.1 -45.65 86.86 Favored 'General case' 0 C--N 1.331 -0.196 0 N-CA-C 109.842 -0.429 . . . . 0.0 109.842 172.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -68.2 -49.32 61.63 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.036 -179.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 2.0 mp0 -50.36 -47.36 56.14 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.541 0.686 . . . . 0.0 110.495 174.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.51 ' HB2' ' O ' ' A' ' 53' ' ' LYS . 0.2 OUTLIER -69.4 -38.81 78.11 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.203 -0.908 . . . . 0.0 111.832 -179.246 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.483 ' CE3' ' HB3' ' A' ' 61' ' ' ALA . 2.3 m95 -53.2 -29.48 32.24 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.435 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 9.4 t70 -58.15 -27.16 63.54 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-O 121.492 0.663 . . . . 0.0 110.767 172.499 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 2.9 m -105.59 13.16 30.36 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.542 0.687 . . . . 0.0 110.096 179.885 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 1.003 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -99.33 175.81 2.26 Favored Pre-proline 0 CA--C 1.547 0.833 0 CA-C-N 115.608 -0.723 . . . . 0.0 110.805 179.713 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 1.003 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 31.6 Cg_endo -60.29 -6.02 4.78 Favored 'Trans proline' 0 C--N 1.365 1.419 0 C-N-CA 124.657 3.571 . . . . 0.0 116.001 -170.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -39.18 -46.73 1.52 Allowed 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -173.309 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 94.2 m-85 -81.49 -9.13 59.77 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -173.659 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 42.27 -136.47 0.29 Allowed 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.249 1.02 . . . . 0.0 112.358 -178.75 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -179.88 -102.05 0.16 Allowed Glycine 0 N--CA 1.447 -0.582 0 N-CA-C 111.555 -0.618 . . . . 0.0 111.555 -176.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.682 ' O ' HG22 ' A' ' 70' ' ' ILE . 4.0 mmp_? -108.74 96.13 6.12 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 110.54 -0.17 . . . . 0.0 110.54 177.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.545 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 16.7 tptm -45.74 -35.09 4.03 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.222 0.609 . . . . 0.0 111.726 178.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.447 ' H ' ' HG3' ' A' ' 69' ' ' GLU . 20.5 mt-10 -50.57 -40.25 51.7 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.027 -0.988 . . . . 0.0 112.12 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.682 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.9 OUTLIER -82.83 -22.1 9.01 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 N-CA-C 111.814 0.302 . . . . 0.0 111.814 -175.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.545 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.09 -40.18 14.7 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 122.866 0.467 . . . . 0.0 111.881 -171.932 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -56.91 -36.84 70.65 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.581 -179.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.61 -26.04 45.27 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 121.159 0.504 . . . . 0.0 110.296 -176.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.587 HD21 HD13 ' A' ' 70' ' ' ILE . 51.4 mt -70.29 -46.31 64.55 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.611 -178.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 0.4 OUTLIER -72.71 -25.85 61.38 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.716 177.179 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -68.26 -39.67 82.14 Favored 'General case' 0 C--N 1.332 -0.173 0 CA-C-O 120.726 0.298 . . . . 0.0 110.702 174.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.454 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -65.8 -47.35 75.4 Favored 'General case' 0 CA--C 1.515 -0.387 0 C-N-CA 120.95 -0.3 . . . . 0.0 110.483 176.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.674 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -49.96 -39.65 41.33 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.597 171.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 22.3 t60 -62.33 -47.69 83.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.224 -178.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.629 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -65.12 -53.95 37.44 Favored 'General case' 0 N--CA 1.449 -0.479 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.597 177.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.599 ' HE1' ' HE3' ' A' ' 33' ' ' LYS . 9.6 t80 -53.94 -30.51 46.84 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.423 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.674 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.0 mt-10 -56.64 -40.66 75.8 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-O 121.011 0.434 . . . . 0.0 111.087 175.063 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 19.9 m -84.96 20.34 1.88 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.463 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.7 t30 71.59 9.65 6.37 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 115.551 -0.75 . . . . 0.0 110.217 -179.354 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.629 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 2.5 t0 -80.79 83.77 6.47 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.489 0.661 . . . . 0.0 110.536 -179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 -72.56 -41.55 65.61 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.094 -179.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -61.08 -43.8 98.33 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.286 -176.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.483 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.0 mt -55.58 -52.79 62.57 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-O 120.802 0.334 . . . . 0.0 110.771 175.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.632 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -61.74 -47.3 85.83 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.792 -176.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.19 -27.67 65.71 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 120.554 -0.458 . . . . 0.0 110.61 -177.781 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -74.76 -32.56 62.11 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.846 0.355 . . . . 0.0 110.254 176.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.3 mt -68.76 -57.2 9.55 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.349 176.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.632 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.9 mm -51.03 -61.85 0.62 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.29 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.208 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.41 ' HA ' ' O ' ' A' ' 98' ' ' ILE . 21.1 t70 -71.33 -18.25 62.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.252 -174.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.96 -11.52 70.02 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.6 -0.81 . . . . 0.0 112.121 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.481 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -108.93 8.68 26.52 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.097 -0.061 . . . . 0.0 111.029 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.481 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.1 m-80 72.95 4.34 4.94 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.313 0.578 . . . . 0.0 110.392 -173.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 1.101 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -83.73 134.88 25.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.294 -0.866 . . . . 0.0 108.736 172.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.53 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 21.3 p -138.97 166.36 24.69 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.772 -177.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.87 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.4 tm? -148.12 104.34 3.58 Favored Pre-proline 0 N--CA 1.449 -0.494 0 CA-C-N 115.825 -0.625 . . . . 0.0 109.743 179.651 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.568 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 32.1 Cg_endo -63.81 -30.54 68.5 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.195 2.597 . . . . 0.0 113.779 -173.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -68.29 -9.55 48.45 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 120.67 0.272 . . . . 0.0 111.671 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.721 ' O ' ' HA ' ' A' ' 33' ' ' LYS . . . 73.49 18.29 79.34 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.754 -0.736 . . . . 0.0 112.328 179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.87 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -95.01 140.31 30.15 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.511 0.672 . . . . 0.0 111.373 -175.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.652 HD11 ' HA ' ' A' ' 78' ' ' ALA . 2.5 tm? -83.15 -16.34 47.08 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 114.398 -1.274 . . . . 0.0 108.184 175.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.662 HG21 ' HG3' ' A' ' 37' ' ' PRO . 59.8 p -91.07 14.99 12.51 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.05 -177.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.522 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 28.9 mt-10 -149.84 144.71 26.14 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 78.9 m -150.86 138.33 19.56 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.665 -0.495 . . . . 0.0 109.665 175.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.434 ' CD1' ' HG2' ' A' ' 115' ' ' ARG . 16.3 m-30 -116.93 122.5 44.48 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.511 0.672 . . . . 0.0 109.533 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 1.101 ' HA ' HG13 ' A' ' 98' ' ' ILE . 2.6 t70 -81.38 148.29 29.4 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.021 -173.43 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -55.26 -27.74 48.56 Favored 'General case' 0 CA--C 1.529 0.145 0 O-C-N 124.551 1.157 . . . . 0.0 112.645 -171.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 29.4 mt -78.95 -7.37 57.96 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.944 0.402 . . . . 0.0 110.874 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 106.39 23.44 7.27 Favored Glycine 0 N--CA 1.45 -0.419 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.182 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.994 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 59.1 m-80 -92.58 161.63 14.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.779 0.323 . . . . 0.0 110.904 -176.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.434 ' HG2' ' CD1' ' A' ' 109' ' ' TYR . 78.0 mtt180 -129.82 128.13 41.71 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.07 0.462 . . . . 0.0 111.187 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . 0.589 ' HE1' ' H ' ' A' ' 67' ' ' ARG . 20.2 m-85 -117.98 124.06 47.25 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.715 171.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -123.88 121.14 34.56 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 114.735 -1.121 . . . . 0.0 109.048 -171.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.59 HD23 HG22 ' A' ' 106' ' ' THR . 38.0 tp -98.99 119.82 59.96 Favored Pre-proline 0 C--N 1.319 -0.757 0 N-CA-C 111.998 0.37 . . . . 0.0 111.998 -170.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.627 ' HB2' ' CD1' ' A' ' 121' ' ' TYR . 24.5 Cg_exo -69.38 156.2 65.03 Favored 'Trans proline' 0 C--O 1.235 0.331 0 C-N-CA 123.313 2.675 . . . . 0.0 112.739 174.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.043 HG22 ' HE1' ' A' ' 39' ' ' TRP . 33.7 m -66.81 -15.79 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-N 115.331 -0.85 . . . . 0.0 112.273 -175.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.627 ' CD1' ' HB2' ' A' ' 119' ' ' PRO . 2.3 p90 -58.67 -21.65 54.84 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-O 120.944 0.402 . . . . 0.0 111.865 -172.327 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 37.0 t -101.61 2.4 38.82 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.179 -175.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . . . . . . . . . 61.9 mt -139.6 -52.05 0.52 Allowed 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 -176.821 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.455 ' O ' ' HB ' ' A' ' 120' ' ' VAL . . . -137.37 114.37 9.67 Favored Pre-proline 0 C--N 1.325 -0.479 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.991 -173.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 124' ' ' ALA . 88.5 Cg_endo -103.3 27.19 0.1 OUTLIER 'Trans proline' 0 CA--C 1.555 1.556 0 C-N-CA 122.973 2.448 . . . . 0.0 117.043 -179.142 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.524 ' HD2' HD13 ' A' ' 127' ' ' ILE . 80.7 Cg_endo -81.35 -19.04 8.09 Favored 'Trans proline' 0 C--N 1.365 1.428 0 CA-C-N 122.268 1.846 . . . . 0.0 112.205 173.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.773 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -100.38 46.07 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.257 0.551 . . . . 0.0 110.442 178.414 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 24.9 p-10 -101.8 -52.77 3.11 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.256 -176.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 50.9 tpp -131.7 131.46 43.09 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 173.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.916 HG22 ' HG2' ' A' ' 131' ' ' GLU . 36.3 mm -99.79 -109.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.815 -172.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.916 ' HG2' HG22 ' A' ' 130' ' ' ILE . 2.3 pt-20 -110.49 125.55 53.43 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-O 121.662 0.744 . . . . 0.0 112.485 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.781 ' HB2' ' HB3' ' A' ' 135' ' ' ASP . 34.7 mm-40 -71.73 -178.99 2.44 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 114.505 -1.225 . . . . 0.0 112.103 -178.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.58 ' HD2' ' N ' ' A' ' 134' ' ' SER . 0.0 OUTLIER -54.78 -47.5 73.87 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 115.969 -0.559 . . . . 0.0 112.11 -176.928 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.58 ' N ' ' HD2' ' A' ' 133' ' ' LYS . 33.0 m -156.91 36.74 0.3 Allowed 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.219 0.533 . . . . 0.0 109.689 -178.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.781 ' HB3' ' HB2' ' A' ' 132' ' ' GLU . 24.8 t70 -98.85 -46.37 5.67 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.634 -0.876 . . . . 0.0 108.634 -179.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.801 HG13 ' HA ' ' A' ' 131' ' ' GLU . 10.6 mm -85.17 139.11 17.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.259 177.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -147.85 -80.25 0.14 Allowed 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.158 -0.474 . . . . 0.0 109.78 177.12 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.6 m -156.32 75.12 0.86 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.33 0.586 . . . . 0.0 109.744 176.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 22.5 tp -157.09 145.01 19.18 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.901 -0.591 . . . . 0.0 109.785 178.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -99.16 -19.96 16.89 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.169 0.509 . . . . 0.0 110.725 -175.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 3.9 pt . . . . . 0 C--O 1.25 1.117 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.942 179.311 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 22.0 m . . . . . 0 N--CA 1.478 0.954 0 N-CA-C 110.663 -0.125 . . . . 0.0 110.663 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.4 mt 55.36 -91.86 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.77 0.669 . . . . 0.0 111.555 -179.088 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -120.43 106.16 11.57 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -160.33 26.34 0.16 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.218 0.532 . . . . 0.0 110.771 -172.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -75.71 -67.73 0.64 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.017 0.437 . . . . 0.0 110.167 178.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.613 ' OG ' ' HD3' ' A' ' 28' ' ' ARG . 12.2 p -165.09 -86.0 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 57.75 80.2 0.18 Allowed 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 113.322 0.86 . . . . 0.0 113.322 168.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 85.5 -9.44 67.71 Favored Glycine 0 N--CA 1.453 -0.187 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.277 175.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 41.6 p -97.62 9.68 41.87 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.719 0.771 . . . . 0.0 109.978 -178.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 116.09 -179.88 17.96 Favored Glycine 0 N--CA 1.443 -0.861 0 CA-C-N 115.191 -0.913 . . . . 0.0 111.126 -176.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.517 HG13 ' H ' ' A' ' 28' ' ' ARG . 88.7 t -126.68 99.59 5.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.658 0 CA-C-O 120.974 0.416 . . . . 0.0 110.214 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -89.71 -80.94 0.3 Allowed 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.418 179.251 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.75 -16.14 63.26 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 120.656 0.265 . . . . 0.0 111.267 -177.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.7 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 110.32 108.98 3.15 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.926 176.579 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.751 ' O ' ' HB ' ' A' ' 99' ' ' THR . 22.1 mmm180 -68.8 -60.76 2.16 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 121.081 0.467 . . . . 0.0 110.996 172.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.415 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 28.0 p-10 -90.11 156.38 18.4 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.337 -174.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.692 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 9.0 pt20 -90.46 117.26 67.87 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -169.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.615 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.0 Cg_exo -70.18 -163.59 0.12 Allowed 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.959 3.106 . . . . 0.0 112.172 170.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 9.8 tt -50.25 139.01 15.53 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.138 -0.483 . . . . 0.0 109.857 175.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.925 ' HZ2' ' HB3' ' A' ' 33' ' ' LYS . 0.0 OUTLIER -107.47 104.98 14.68 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.713 -170.057 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.579 ' HD3' ' O ' ' A' ' 34' ' ' LYS . 11.8 tmtt? -99.14 -24.12 14.99 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.51 178.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.611 ' OE1' ' HB3' ' A' ' 102' ' ' HIS . 44.3 mt-10 -71.39 167.4 19.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.524 0.678 . . . . 0.0 112.226 -174.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.466 ' N ' ' HD2' ' A' ' 36' ' ' LYS . 0.0 OUTLIER -105.86 152.9 40.34 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 114.947 -1.024 . . . . 0.0 111.328 -166.22 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.76 ' HG3' HG21 ' A' ' 106' ' ' THR . 24.8 Cg_exo -62.01 144.88 96.74 Favored 'Trans proline' 0 C--N 1.353 0.774 0 C-N-CA 123.021 2.481 . . . . 0.0 111.913 177.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.508 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 18.3 ttpp -112.22 115.88 29.53 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -168.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 1.008 ' HE1' HG12 ' A' ' 120' ' ' VAL . 1.1 p-90 170.71 20.84 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 113.2 -1.818 . . . . 0.0 109.966 173.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.567 ' HD2' ' O ' ' A' ' 41' ' ' SER . 1.6 tmmt? -128.34 147.97 50.65 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 121.04 0.448 . . . . 0.0 110.733 -159.563 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.567 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 58.2 m -64.62 140.31 58.85 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.252 -0.885 . . . . 0.0 111.571 -175.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -56.97 -39.36 74.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.678 175.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -140.99 92.22 8.68 Favored Pre-proline 0 C--N 1.325 -0.482 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.053 171.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.553 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 7.4 Cg_exo -72.42 134.58 22.85 Favored 'Trans proline' 0 N--CA 1.457 -0.624 0 C-N-CA 122.477 2.118 . . . . 0.0 110.502 175.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 5.1 ttp -112.66 -86.12 0.57 Allowed 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.628 -0.429 . . . . 0.0 111.254 -175.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.579 ' HA ' ' CG ' ' A' ' 131' ' ' GLU . 46.4 p -117.67 -173.81 2.5 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.468 ' OD2' ' HD2' ' A' ' 51' ' ' ARG . 16.5 t70 -49.44 -44.87 45.87 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.866 179.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -53.19 -42.79 63.22 Favored Glycine 0 C--N 1.332 0.353 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.286 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 14.0 mm100 -72.23 -41.96 66.26 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.722 0.296 . . . . 0.0 110.333 179.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -57.75 -57.37 13.04 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.159 179.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.468 ' HD2' ' OD2' ' A' ' 47' ' ' ASP . 12.0 ptm180 -63.64 -45.52 89.84 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.537 -0.301 . . . . 0.0 111.494 -175.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 31.1 t -65.41 -53.79 37.97 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.846 -176.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 49' ' ' GLN . 0.5 OUTLIER -65.77 -35.22 80.1 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.963 -179.363 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.44 ' HG3' ' CZ3' ' A' ' 39' ' ' TRP . 59.5 ttp180 -56.07 -46.5 78.96 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 120.435 0.159 . . . . 0.0 110.928 178.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -66.11 -52.7 46.22 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-O 120.998 0.428 . . . . 0.0 110.678 -177.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 55.3 mt-10 -55.76 -49.7 72.4 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.396 178.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.6 m-85 -66.17 -45.27 81.51 Favored 'General case' 0 C--O 1.217 -0.653 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.564 -179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.423 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -50.14 -36.62 30.73 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 112.064 0.394 . . . . 0.0 112.064 -179.286 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -54.94 -41.02 70.55 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.724 0.297 . . . . 0.0 111.542 175.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 1.4 m -113.08 10.59 18.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.187 0.518 . . . . 0.0 111.376 -176.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.751 ' O ' ' HB2' ' A' ' 117' ' ' GLN . . . -66.55 -60.18 6.97 Favored Pre-proline 0 C--O 1.222 -0.351 0 CA-C-O 119.085 -0.484 . . . . 0.0 111.047 -177.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.728 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 95.9 Cg_endo -87.05 -9.73 6.11 Favored 'Trans proline' 0 C--N 1.352 0.75 0 C-N-CA 121.876 1.717 . . . . 0.0 111.712 176.362 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 63.46 -103.32 0.11 Allowed 'General case' 0 C--N 1.333 -0.142 0 CA-C-N 115.032 -0.985 . . . . 0.0 111.626 -178.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.2 m-85 -109.52 -8.62 14.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.725 -0.216 . . . . 0.0 110.934 -177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 56.42 -112.23 0.68 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.36 -0.607 . . . . 0.0 109.36 -166.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 141.91 -99.72 0.24 Allowed Glycine 0 N--CA 1.445 -0.761 0 C-N-CA 119.513 -1.327 . . . . 0.0 113.824 177.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.616 ' HD3' ' OD2' ' A' ' 110' ' ' ASP . 7.8 ttt180 -99.5 113.81 26.41 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 122.894 0.478 . . . . 0.0 109.758 -173.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.456 ' HD3' ' HD1' ' A' ' 71' ' ' TRP . 72.9 mmtt -75.64 -26.65 57.92 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.044 0.45 . . . . 0.0 110.374 179.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -58.09 -37.16 73.97 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.168 179.91 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.682 HD12 HG12 ' A' ' 98' ' ' ILE . 0.8 OUTLIER -82.97 -22.01 8.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 115.759 -0.655 . . . . 0.0 111.553 -179.41 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.56 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -47.28 -41.73 19.44 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 111.704 0.261 . . . . 0.0 111.704 -172.83 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.566 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 11.9 m-20 -56.44 -31.29 63.8 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 179.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.08 -33.13 50.9 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.203 0.525 . . . . 0.0 110.024 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.523 HD21 HD13 ' A' ' 70' ' ' ILE . 26.3 mt -70.55 -45.45 65.42 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.527 -177.157 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.566 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 14.1 ptpt -68.9 -33.08 73.18 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.776 177.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.413 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -67.32 -36.05 80.67 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 120.954 0.407 . . . . 0.0 110.659 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.501 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -69.92 -48.99 56.38 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.708 177.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -52.6 -33.96 48.65 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.503 173.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.413 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 29.5 t60 -65.95 -51.36 59.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.509 -179.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.427 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -64.14 -46.7 82.94 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.676 177.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 15.2 t80 -59.43 -33.61 71.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.241 -179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -60.46 -38.44 84.21 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-O 121.304 0.573 . . . . 0.0 110.823 171.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.426 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 22.7 t -85.72 21.31 1.9 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.322 -177.316 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 83' ' ' SER . 16.5 m120 73.82 0.43 3.63 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.492 -0.776 . . . . 0.0 111.838 179.215 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.653 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 14.8 m-20 -79.07 83.31 5.16 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.687 0.756 . . . . 0.0 110.314 178.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 58.6 m80 -71.9 -40.59 68.75 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.06 -0.973 . . . . 0.0 110.28 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.708 ' HA ' HE21 ' A' ' 90' ' ' GLN . 5.3 pt-20 -74.46 -31.52 62.28 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.321 -0.854 . . . . 0.0 111.26 -175.076 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.653 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 10.1 mt -58.87 -51.55 69.54 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.174 0.511 . . . . 0.0 110.204 173.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.551 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -62.41 -44.23 96.93 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.001 -175.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.708 HE21 ' HA ' ' A' ' 87' ' ' GLU . 26.2 pt20 -66.88 -33.31 75.32 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 120.572 -0.451 . . . . 0.0 110.729 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.23 -26.24 61.05 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.855 179.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 88' ' ' LEU . 51.1 mt -74.15 -55.12 13.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.813 177.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.551 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.8 mm -52.18 -59.18 1.62 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.371 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.551 176.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.86 -27.26 68.75 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.709 -179.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -64.78 -20.52 66.43 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-N 115.531 -0.758 . . . . 0.0 113.098 -177.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.542 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -84.48 -53.22 5.58 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 117.136 0.468 . . . . 0.0 110.21 179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.542 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 23.4 t-20 152.29 -28.29 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 106.659 -1.608 . . . . 0.0 106.659 -175.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 1.015 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.7 mp -57.66 145.38 8.74 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.602 0 CA-C-N 112.44 -2.163 . . . . 0.0 111.734 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.751 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 33.7 p -132.74 165.47 24.44 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.568 -177.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.845 HD22 ' HD2' ' A' ' 101' ' ' PRO . 2.3 tm? -150.84 113.51 3.16 Favored Pre-proline 0 C--N 1.329 -0.31 0 N-CA-C 109.158 -0.682 . . . . 0.0 109.158 173.053 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.845 ' HD2' HD22 ' A' ' 100' ' ' LEU . 13.2 Cg_endo -55.68 -42.14 70.47 Favored 'Trans proline' 0 CA--C 1.533 0.442 0 C-N-CA 124.012 3.141 . . . . 0.0 114.759 -171.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.611 ' HB3' ' OE1' ' A' ' 35' ' ' GLU . 5.4 m-70 -72.66 -21.25 61.11 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 112.717 0.636 . . . . 0.0 112.717 -176.562 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.615 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 86.15 17.12 61.55 Favored Glycine 0 N--CA 1.448 -0.563 0 C-N-CA 120.317 -0.944 . . . . 0.0 112.933 -173.499 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.677 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -93.6 143.56 26.2 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.064 0.459 . . . . 0.0 110.971 -175.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.705 ' HB2' ' HG3' ' A' ' 33' ' ' LYS . 3.0 tm? -78.49 -32.03 48.02 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.779 -178.113 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.76 HG21 ' HG3' ' A' ' 37' ' ' PRO . 53.3 p -84.47 16.83 2.91 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.549 -172.458 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.603 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 41.1 mt-10 -148.5 140.95 24.28 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 108.07 -1.085 . . . . 0.0 108.07 174.091 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 76.8 m -152.19 145.14 24.45 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 110.485 -0.191 . . . . 0.0 110.485 177.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.2 m-30 -118.67 122.8 43.37 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.273 0.559 . . . . 0.0 109.675 178.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 1.015 ' HA ' HG13 ' A' ' 98' ' ' ILE . 12.6 t70 -80.92 148.41 29.87 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 114.9 -1.045 . . . . 0.0 110.236 -178.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -57.5 -24.31 55.13 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 114.797 -1.092 . . . . 0.0 112.331 -171.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.419 HD12 ' HD2' ' A' ' 67' ' ' ARG . 27.7 mt -79.23 -5.07 53.5 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 120.928 0.394 . . . . 0.0 110.949 -178.625 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 100.43 29.85 6.49 Favored Glycine 0 N--CA 1.448 -0.561 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.154 179.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.772 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 17.1 m120 -101.52 158.23 16.23 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.91 -0.171 . . . . 0.0 110.764 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -129.45 129.71 44.98 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.368 0.604 . . . . 0.0 110.762 179.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . 0.516 ' HE1' ' H ' ' A' ' 67' ' ' ARG . 17.3 m-85 -117.71 128.44 54.9 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.516 -0.765 . . . . 0.0 109.869 177.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.751 ' HB2' ' O ' ' A' ' 61' ' ' ALA . 3.8 mm100 -123.21 127.23 48.33 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 179.161 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.511 HD23 HG22 ' A' ' 106' ' ' THR . 36.1 tp -98.75 124.24 46.73 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.385 -171.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.652 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 12.3 Cg_exo -72.82 155.04 53.93 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 123.33 2.687 . . . . 0.0 112.777 177.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.008 HG12 ' HE1' ' A' ' 39' ' ' TRP . 0.3 OUTLIER -76.45 -20.38 15.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 114.901 -1.045 . . . . 0.0 112.515 -171.244 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.652 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -57.08 -30.09 64.03 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.719 -0.673 . . . . 0.0 112.147 -171.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 46.9 t -94.51 -6.53 43.6 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.556 -0.293 . . . . 0.0 111.302 -173.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.495 HD12 ' HG3' ' A' ' 37' ' ' PRO . 94.6 mt -118.63 -54.12 2.28 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -175.492 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.432 ' HB3' HG22 ' A' ' 120' ' ' VAL . . . -117.67 111.75 39.33 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.154 0.502 . . . . 0.0 111.929 -172.357 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.37 -39.53 45.94 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 123.745 2.964 . . . . 0.0 115.862 176.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -42.69 -59.12 1.04 Allowed 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.658 2.239 . . . . 0.0 114.507 -175.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.844 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -85.59 18.05 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.894 0.378 . . . . 0.0 111.746 -176.609 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -107.39 -18.38 13.88 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 172.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 44.5 ttm -102.77 -54.04 2.73 Favored 'General case' 0 C--O 1.222 -0.359 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.935 173.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.632 ' HB ' ' OE2' ' A' ' 131' ' ' GLU . 18.3 mt 66.75 -79.8 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 O-C-N 124.059 0.849 . . . . 0.0 112.178 176.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.752 ' HB2' HG13 ' A' ' 136' ' ' ILE . 2.3 mp0 -61.13 138.25 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 O-C-N 123.561 0.538 . . . . 0.0 110.315 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -87.63 -169.55 2.65 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.031 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -77.5 74.42 4.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.561 0.696 . . . . 0.0 111.253 -172.216 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 18.5 p -108.04 -75.83 0.62 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.0 169.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -98.52 -30.11 12.7 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.223 173.033 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.752 HG13 ' HB2' ' A' ' 131' ' ' GLU . 29.2 mm -62.12 158.53 3.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 114.203 -1.362 . . . . 0.0 111.644 -177.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.403 ' N ' HG22 ' A' ' 136' ' ' ILE . 29.0 mt-10 -117.52 123.18 45.66 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 -176.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 8.0 m -68.39 100.08 1.03 Allowed 'General case' 0 C--N 1.309 -1.155 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.475 175.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 9.6 mp -79.41 167.85 20.29 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.91 0.386 . . . . 0.0 110.955 178.768 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -122.78 21.22 10.03 Favored 'General case' 0 CA--C 1.514 -0.431 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -178.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 8.0 pt . . . . . 0 C--O 1.25 1.091 0 CA-C-N 114.71 -1.132 . . . . 0.0 111.552 177.218 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 21.5 m . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 120.606 0.241 . . . . 0.0 110.438 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 64.74 36.21 8.26 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.966 178.571 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.508 ' ND2' ' HG3' ' A' ' 17' ' ' GLU . 16.6 t30 -149.7 135.92 18.96 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.918 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.508 ' HG3' ' ND2' ' A' ' 16' ' ' ASN . 54.4 mt-10 63.59 59.17 1.22 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.264 0.554 . . . . 0.0 110.41 -177.278 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -76.93 132.5 39.1 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.744 -178.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 t 61.33 -87.42 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 115.323 -0.853 . . . . 0.0 112.046 175.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 86.7 mt-10 -84.6 -17.57 38.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.781 0.324 . . . . 0.0 111.231 -176.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 83.54 -47.32 3.81 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.427 178.59 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.0 t -66.36 -18.65 65.48 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-O 121.04 0.448 . . . . 0.0 110.826 179.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -147.84 -147.15 4.48 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.471 -1.052 . . . . 0.0 110.471 176.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.42 ' O ' ' HB2' ' A' ' 25' ' ' ALA . 4.9 p -92.38 -31.62 4.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 174.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' A' ' 24' ' ' VAL . . . 167.55 -94.16 0.0 OUTLIER 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 124.5 1.12 . . . . 0.0 107.982 172.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.461 HD21 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -126.57 -3.99 6.61 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 114.519 -1.219 . . . . 0.0 109.142 175.021 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.66 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 120.19 45.52 0.4 Allowed Glycine 0 N--CA 1.443 -0.855 0 CA-C-N 114.16 -1.382 . . . . 0.0 110.559 -175.508 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.593 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.0 ppt_? -64.32 -32.34 73.9 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-O 120.84 0.352 . . . . 0.0 111.238 -173.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.715 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -93.39 156.73 16.61 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 171.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.425 ' HG3' ' HB3' ' A' ' 100' ' ' LEU . 0.9 OUTLIER -81.12 104.21 2.64 Favored Pre-proline 0 C--N 1.328 -0.355 0 N-CA-C 113.691 0.997 . . . . 0.0 113.691 -158.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.935 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 92.5 Cg_endo -78.87 -162.46 0.18 Allowed 'Trans proline' 0 CA--C 1.539 0.73 0 C-N-CA 123.733 2.955 . . . . 0.0 111.839 172.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.561 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.1 mp -49.01 144.68 4.53 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-O 121.308 0.575 . . . . 0.0 112.044 175.092 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.547 ' HD2' ' N ' ' A' ' 33' ' ' LYS . 8.6 mptt -84.85 83.29 8.09 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.313 -178.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 15.1 mtmt -97.68 -18.33 18.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.458 -0.792 . . . . 0.0 111.936 -178.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.924 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 9.2 tp10 -87.16 159.73 18.77 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.223 0.535 . . . . 0.0 110.451 -177.711 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.48 ' HG2' ' OE2' ' A' ' 35' ' ' GLU . 16.6 pttm -99.99 155.13 36.79 Favored Pre-proline 0 C--N 1.323 -0.556 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.109 -173.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.635 ' HA ' ' HB ' ' A' ' 106' ' ' THR . 5.1 Cg_exo -73.97 143.28 32.57 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.302 2.001 . . . . 0.0 111.514 176.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.737 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 23.5 ttpp -110.88 145.69 37.83 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.225 -171.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 1.103 ' HE1' HG22 ' A' ' 120' ' ' VAL . 0.9 OUTLIER 134.43 -3.68 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 O-C-N 125.227 1.579 . . . . 0.0 109.844 -172.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? -113.48 158.73 20.33 Favored 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 109.955 -0.387 . . . . 0.0 109.955 -167.199 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.448 ' HB2' ' HG3' ' A' ' 44' ' ' PRO . 25.0 m -65.23 125.26 24.46 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.524 -179.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -61.91 -26.35 68.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.407 176.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -146.0 88.95 6.19 Favored Pre-proline 0 C--N 1.325 -0.5 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.395 173.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.448 ' HG3' ' HB2' ' A' ' 41' ' ' SER . 6.4 Cg_exo -75.4 137.34 20.72 Favored 'Trans proline' 0 N--CA 1.463 -0.302 0 C-N-CA 122.924 2.416 . . . . 0.0 111.273 176.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 64.1 mtm -114.66 -75.39 0.59 Allowed 'General case' 0 C--O 1.218 -0.559 0 N-CA-C 112.042 0.386 . . . . 0.0 112.042 -177.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.815 ' HA ' ' HG2' ' A' ' 131' ' ' GLU . 78.3 p -115.54 175.68 5.41 Favored 'General case' 0 C--N 1.318 -0.799 0 C-N-CA 120.474 -0.491 . . . . 0.0 111.323 -178.694 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -61.01 -41.89 97.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.015 0.436 . . . . 0.0 110.077 176.115 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.81 -44.3 87.07 Favored Glycine 0 N--CA 1.45 -0.402 0 CA-C-N 115.507 -0.77 . . . . 0.0 111.697 177.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -68.67 -45.07 72.69 Favored 'General case' 0 C--O 1.22 -0.466 0 N-CA-C 110.395 -0.224 . . . . 0.0 110.395 176.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -54.92 -47.47 74.34 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.797 -177.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.42 HH11 ' HD2' ' A' ' 51' ' ' ARG . 10.0 ptm180 -73.42 -39.44 65.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.604 0.24 . . . . 0.0 111.477 -176.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 m -68.82 -42.18 77.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.216 0.531 . . . . 0.0 110.091 -179.738 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.449 ' HD3' ' HA ' ' A' ' 53' ' ' LYS . 60.1 mmtt -71.58 -32.57 68.21 Favored 'General case' 0 N--CA 1.45 -0.449 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.055 177.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -53.2 -48.46 68.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.088 0.471 . . . . 0.0 110.041 175.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -61.35 -52.58 64.07 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.99 177.173 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -56.79 -49.34 75.61 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 114.722 -1.127 . . . . 0.0 111.734 -177.048 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.404 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 42.6 m-85 -70.36 -37.16 74.55 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.744 -179.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -54.18 -37.56 64.64 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 177.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -66.74 -20.29 65.93 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.826 0.346 . . . . 0.0 111.784 176.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 15.4 m -95.08 -11.87 27.53 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.66 0.743 . . . . 0.0 109.659 178.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.465 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -86.0 158.23 56.12 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.424 -179.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.465 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 19.3 Cg_endo -85.2 -10.57 7.85 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 123.016 2.478 . . . . 0.0 113.749 -170.454 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 54.61 -111.12 0.6 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.602 -0.727 . . . . 0.0 112.446 179.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.3 m-85 -108.57 -1.49 19.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.888 0.375 . . . . 0.0 110.893 -176.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -76.31 151.71 36.62 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.833 -172.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.433 ' HA2' ' CE1' ' A' ' 116' ' ' TYR . . . 136.47 179.01 16.24 Favored Glycine 0 N--CA 1.443 -0.835 0 CA-C-N 115.417 -0.811 . . . . 0.0 111.922 -178.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.679 ' O ' HG22 ' A' ' 70' ' ' ILE . 2.7 mmp_? -63.66 80.89 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 171.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.495 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 13.5 tptm -49.62 -37.82 29.5 Favored 'General case' 0 C--N 1.327 -0.395 0 C-N-CA 122.897 0.479 . . . . 0.0 112.119 -172.369 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 27.7 mt-10 -52.41 -40.74 62.51 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.186 176.319 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.679 HG22 ' O ' ' A' ' 67' ' ' ARG . 0.8 OUTLIER -84.32 -23.81 7.61 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 C-N-CA 120.992 -0.283 . . . . 0.0 110.9 177.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.639 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -53.0 -38.49 62.36 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.259 -173.316 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.583 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 18.4 m-20 -62.49 -28.67 69.99 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.25 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -79.95 -27.58 39.75 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 121.519 0.676 . . . . 0.0 109.551 -179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.662 HD13 ' SG ' ' A' ' 108' ' ' CYS . 27.7 mt -74.71 -43.55 54.51 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.19 -0.914 . . . . 0.0 110.527 -178.393 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.639 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 11.1 ptpt -70.53 -29.83 66.42 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.692 -0.686 . . . . 0.0 110.61 176.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.97 -38.29 72.77 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.767 175.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -65.64 -44.24 87.03 Favored 'General case' 0 CA--C 1.51 -0.573 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 175.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.514 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -48.45 -41.14 28.62 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.694 170.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.438 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 29.7 t60 -62.26 -48.94 77.71 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.329 -178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.407 ' O ' ' HB2' ' A' ' 85' ' ' ASP . . . -62.5 -53.03 60.84 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.622 178.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.522 ' HD2' HD22 ' A' ' 123' ' ' LEU . 20.6 t80 -55.47 -39.34 70.27 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.526 179.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.513 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 45.3 mt-10 -61.1 -33.75 73.87 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 174.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.427 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 8.1 t -87.57 20.11 3.08 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.159 -177.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 83' ' ' SER . 3.4 m-20 73.44 4.8 4.89 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.751 0.82 . . . . 0.0 111.599 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.857 ' HB3' ' HB2' ' A' ' 88' ' ' LEU . 54.0 m-20 -82.35 84.1 7.25 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.825 0.821 . . . . 0.0 110.966 -179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.561 ' NE2' ' HA ' ' A' ' 32' ' ' LEU . 8.0 t-80 -69.03 -42.3 76.56 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 114.556 -1.202 . . . . 0.0 110.113 177.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.33 -33.75 71.86 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.308 -0.86 . . . . 0.0 111.146 -177.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.857 ' HB2' ' HB3' ' A' ' 85' ' ' ASP . 7.0 mp -65.32 -56.32 13.34 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.484 -0.326 . . . . 0.0 110.975 179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.616 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.67 -41.11 89.89 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.207 -0.452 . . . . 0.0 111.508 -176.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . . . . . . . . . 19.0 pt20 -69.35 -30.35 68.36 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.433 -0.507 . . . . 0.0 111.018 -179.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.63 -21.99 51.43 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.938 0.399 . . . . 0.0 110.762 178.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 52.9 mt -77.93 -56.84 6.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 116.141 -0.482 . . . . 0.0 110.538 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.616 HG12 ' O ' ' A' ' 89' ' ' ALA . 10.1 mm -50.52 -60.67 0.79 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.122 176.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -67.02 -24.96 66.07 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.1 -176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -70.38 -16.74 73.78 Favored Glycine 0 N--CA 1.447 -0.603 0 C-N-CA 120.806 -0.711 . . . . 0.0 111.859 178.583 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -97.99 5.59 48.64 Favored 'General case' 0 N--CA 1.451 -0.419 0 O-C-N 122.718 -0.284 . . . . 0.0 110.893 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 65.6 t30 78.14 0.65 2.71 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.724 0.773 . . . . 0.0 109.76 -176.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.943 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.5 mp -89.71 144.92 8.1 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.179 -0.918 . . . . 0.0 109.426 177.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.593 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 22.7 p -140.62 171.1 14.58 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 120.423 -0.511 . . . . 0.0 111.456 -177.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.754 HD12 ' H ' ' A' ' 104' ' ' ALA . 1.6 tm? -148.59 103.36 3.46 Favored Pre-proline 0 N--CA 1.449 -0.487 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.13 -179.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.66 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 21.2 Cg_endo -60.7 -25.13 80.38 Favored 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.763 2.975 . . . . 0.0 114.094 -174.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.556 ' H ' HD13 ' A' ' 100' ' ' LEU . 90.8 m-70 -76.26 -13.08 60.17 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.889 0.375 . . . . 0.0 110.402 177.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.935 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 77.32 9.18 86.97 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.993 -0.549 . . . . 0.0 112.652 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.924 ' HB2' ' HB3' ' A' ' 35' ' ' GLU . . . -94.47 142.82 26.99 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-O 121.65 0.738 . . . . 0.0 111.612 -174.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.537 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.5 tm? -78.64 -14.23 59.42 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.225 -1.352 . . . . 0.0 107.792 173.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.635 ' HB ' ' HA ' ' A' ' 37' ' ' PRO . 25.4 p -84.24 6.85 21.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 114.313 -1.312 . . . . 0.0 111.153 -175.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -145.06 161.1 40.27 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 175.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.692 ' SG ' ' HB2' ' A' ' 116' ' ' TYR . 3.9 p -155.53 133.03 11.06 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.79 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.503 ' HA ' ' O ' ' A' ' 114' ' ' ASN . 19.4 m-30 -118.75 121.32 39.81 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-O 121.568 0.699 . . . . 0.0 109.573 177.148 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.943 ' HA ' HG13 ' A' ' 98' ' ' ILE . 0.3 OUTLIER -87.29 152.27 22.43 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 114.303 -1.317 . . . . 0.0 110.773 -174.334 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -59.07 -25.47 63.79 Favored 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 114.854 -1.067 . . . . 0.0 112.645 -169.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.9 mt -79.05 -11.53 60.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.017 0.437 . . . . 0.0 110.553 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 107.72 31.19 3.75 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.057 -178.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.902 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 43.7 m-80 -96.11 145.09 25.79 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.689 0.281 . . . . 0.0 111.179 -179.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.477 ' HA ' ' HD1' ' A' ' 109' ' ' TYR . 18.6 ptt180 -123.94 128.4 49.37 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.028 -0.533 . . . . 0.0 109.647 175.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . 0.692 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 35.3 m-85 -128.25 148.04 50.62 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 176.214 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.42 ' O ' ' HG3' ' A' ' 62' ' ' PRO . 9.3 mm100 -121.3 120.89 36.42 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.425 -173.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.723 HD12 ' HD2' ' A' ' 119' ' ' PRO . 13.9 tp -96.57 117.07 66.33 Favored Pre-proline 0 C--N 1.316 -0.868 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.584 -172.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.764 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 35.1 Cg_exo -62.51 154.99 60.87 Favored 'Trans proline' 0 C--N 1.351 0.697 0 C-N-CA 123.821 3.014 . . . . 0.0 113.744 178.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.103 HG22 ' HE1' ' A' ' 39' ' ' TRP . 3.7 m -68.84 -16.49 20.97 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.323 0 CA-C-N 115.141 -0.936 . . . . 0.0 112.223 -174.655 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.764 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.1 p90 -61.26 -18.28 57.63 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -169.879 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.5 t -121.06 14.54 11.46 Favored 'General case' 0 C--N 1.324 -0.52 0 C-N-CA 121.196 -0.202 . . . . 0.0 111.059 -176.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.605 ' CD1' HG22 ' A' ' 106' ' ' THR . 95.8 mt -140.77 -52.22 0.47 Allowed 'General case' 0 CA--C 1.52 -0.197 0 C-N-CA 120.543 -0.463 . . . . 0.0 111.898 -178.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.527 ' HB3' ' HB ' ' A' ' 120' ' ' VAL . . . -109.85 156.45 39.85 Favored Pre-proline 0 C--N 1.32 -0.685 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.621 -169.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.566 ' HB3' ' HD2' ' A' ' 126' ' ' PRO . 74.1 Cg_exo -53.3 -168.15 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.269 0 C-N-CA 123.618 2.879 . . . . 0.0 112.158 170.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.566 ' HD2' ' HB3' ' A' ' 125' ' ' PRO . 82.8 Cg_endo -69.74 13.51 0.28 Allowed 'Trans proline' 0 C--N 1.357 1.022 0 C-N-CA 122.041 1.827 . . . . 0.0 112.654 -178.329 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.438 ' H ' ' C ' ' A' ' 125' ' ' PRO . 42.5 mm 68.4 -42.8 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.191 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 -177.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.486 ' O ' HG13 ' A' ' 130' ' ' ILE . 49.9 t30 -153.01 149.01 27.73 Favored 'General case' 0 N--CA 1.419 -2.007 0 N-CA-C 106.149 -1.797 . . . . 0.0 106.149 -177.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . 0.726 ' SD ' ' HA ' ' A' ' 134' ' ' SER . 52.3 ttm -64.62 -17.26 63.84 Favored 'General case' 0 C--N 1.302 -1.461 0 CA-C-O 121.51 0.672 . . . . 0.0 109.557 175.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.486 HG13 ' O ' ' A' ' 128' ' ' ASN . 45.4 mt 71.91 -86.07 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 CA-C-N 114.365 -1.289 . . . . 0.0 110.741 170.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.815 ' HG2' ' HA ' ' A' ' 46' ' ' THR . 29.1 mt-10 -79.78 143.98 33.97 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 121.044 0.45 . . . . 0.0 110.696 -175.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -67.13 -178.99 0.88 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.82 -177.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.558 ' HE3' ' HB2' ' A' ' 135' ' ' ASP . 21.5 ttpp 71.26 -1.39 2.75 Favored 'General case' 0 CA--C 1.529 0.137 0 CA-C-N 115.142 -0.935 . . . . 0.0 111.572 175.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.726 ' HA ' ' SD ' ' A' ' 129' ' ' MET . 19.7 m 59.29 41.72 19.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.518 -178.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . 0.558 ' HB2' ' HE3' ' A' ' 133' ' ' LYS . 15.1 t70 -86.7 -37.57 17.82 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -176.317 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . . . . . . . . . 15.6 mm -82.21 136.06 23.71 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 114.757 -1.111 . . . . 0.0 109.446 173.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 50.04 70.28 0.52 Allowed 'General case' 0 C--O 1.235 0.304 0 O-C-N 123.704 0.627 . . . . 0.0 109.922 -173.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 5.6 m -75.31 76.51 2.41 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.15 -174.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 20.9 tp -98.22 119.27 36.58 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.881 -0.6 . . . . 0.0 109.542 175.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -90.86 -36.03 14.43 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.565 0.698 . . . . 0.0 109.74 -177.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 2.7 pt . . . . . 0 C--O 1.248 0.975 0 CA-C-N 114.904 -1.044 . . . . 0.0 110.966 179.852 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 6.5 p . . . . . 0 N--CA 1.477 0.898 0 CA-C-O 120.619 0.247 . . . . 0.0 110.494 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.431 HD22 ' HA ' ' A' ' 15' ' ' LEU . 1.6 tm? -99.26 94.48 6.49 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 179.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.496 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 3.5 t-20 -143.73 130.66 20.48 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.692 -0.686 . . . . 0.0 109.604 179.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 17.9 mm-40 75.81 129.56 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.379 0 O-C-N 124.422 1.076 . . . . 0.0 111.825 -179.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 22.7 m120 -117.28 -177.34 3.2 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.196 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.2 t -146.98 47.12 1.16 Allowed 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.393 178.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -77.86 162.06 27.14 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-N 115.696 -0.683 . . . . 0.0 110.283 -178.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 80.26 -46.23 3.17 Favored Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.879 -0.677 . . . . 0.0 111.738 -177.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 10.1 t -101.89 11.38 38.7 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.296 0.57 . . . . 0.0 109.807 175.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -172.2 -173.67 39.06 Favored Glycine 0 N--CA 1.444 -0.803 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.846 -178.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.438 HG13 ' HG3' ' A' ' 28' ' ' ARG . 32.9 m -78.31 -31.25 16.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 121.519 0.676 . . . . 0.0 111.11 -177.458 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . 179.56 -39.59 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 -174.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.684 HD13 ' H ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -121.02 -165.17 1.19 Allowed 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 114.032 -1.44 . . . . 0.0 107.457 165.6 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.789 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . -100.69 78.81 0.43 Allowed Glycine 0 C--N 1.309 -0.935 0 C-N-CA 121.199 -0.524 . . . . 0.0 112.131 -173.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.701 ' O ' ' HB ' ' A' ' 99' ' ' THR . 7.9 mmt85 -33.96 -62.87 0.29 Allowed 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 123.511 0.724 . . . . 0.0 112.778 174.305 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.617 ' HB2' ' OD2' ' A' ' 94' ' ' ASP . 3.3 p-10 -89.87 156.84 18.2 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.498 -175.092 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -84.52 109.76 22.22 Favored Pre-proline 0 C--N 1.325 -0.5 0 N-CA-C 112.889 0.699 . . . . 0.0 112.889 -166.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.776 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 88.1 Cg_endo -79.1 -164.92 0.3 Allowed 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 123.702 2.935 . . . . 0.0 111.467 169.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.04 149.24 19.55 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.385 0.612 . . . . 0.0 112.114 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.635 ' HE2' ' N ' ' A' ' 33' ' ' LYS . 0.2 OUTLIER -75.69 102.52 5.41 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.271 -0.877 . . . . 0.0 111.047 -172.436 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -97.29 -20.87 17.58 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.475 -178.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.676 ' HB2' ' HB2' ' A' ' 104' ' ' ALA . 47.1 mt-10 -103.28 171.86 7.14 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 122.03 0.919 . . . . 0.0 113.266 -172.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.608 ' O ' ' HE2' ' A' ' 38' ' ' LYS . 26.7 pttt -106.84 160.29 26.83 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 113.27 -1.786 . . . . 0.0 109.409 -178.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.856 ' HG2' HG12 ' A' ' 120' ' ' VAL . 10.6 Cg_endo -61.58 139.29 80.63 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.266 1.977 . . . . 0.0 112.557 172.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.654 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 2.7 mtmt -112.14 147.81 35.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.11 -0.496 . . . . 0.0 112.198 -175.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.99 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.9 p-90 132.27 -16.39 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.616 1.967 . . . . 0.0 108.289 -175.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.642 ' HG2' HG13 ' A' ' 127' ' ' ILE . 10.1 tppt? -113.45 153.69 28.24 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.365 -174.12 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 48.9 m -65.49 135.02 54.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.265 -177.723 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 8.7 p-10 -72.08 -27.34 62.61 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.771 -0.649 . . . . 0.0 109.69 175.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 59.9 t80 -131.78 81.99 61.67 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.624 -0.716 . . . . 0.0 109.108 170.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.43 130.11 16.83 Favored 'Trans proline' 0 N--CA 1.46 -0.493 0 C-N-CA 122.603 2.202 . . . . 0.0 111.053 177.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.538 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.0 mtp -102.1 -87.64 0.4 Allowed 'General case' 0 C--N 1.319 -0.719 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 -174.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.572 ' HA ' ' HG2' ' A' ' 131' ' ' GLU . 69.1 p -118.78 179.09 4.24 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.365 178.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.517 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 11.7 t70 -54.66 -48.04 72.82 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -178.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -59.16 -35.15 82.98 Favored Glycine 0 CA--C 1.52 0.353 0 C-N-CA 121.232 -0.508 . . . . 0.0 112.608 -178.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.695 ' O ' ' HB2' ' A' ' 53' ' ' LYS . 31.3 mm-40 -70.13 -51.55 30.61 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 175.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.439 HD21 ' HZ2' ' A' ' 40' ' ' LYS . 3.2 tm? -55.94 -47.97 76.6 Favored 'General case' 0 C--O 1.22 -0.458 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.808 -177.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.649 ' HG3' ' N ' ' A' ' 52' ' ' SER . 13.6 ptp180 -62.9 -48.94 76.78 Favored 'General case' 0 C--N 1.327 -0.396 0 O-C-N 123.235 0.334 . . . . 0.0 111.586 -177.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.649 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 24.3 t -68.46 -47.2 67.75 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 108.928 -0.768 . . . . 0.0 108.928 -176.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.695 ' HB2' ' O ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -55.11 -44.45 74.99 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.512 173.897 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.42 ' O ' ' HB2' ' A' ' 58' ' ' TRP . 62.0 ttt180 -60.77 -53.04 62.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.305 -179.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -62.05 -49.93 74.02 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.77 -176.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -51.97 -49.49 63.13 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.251 -0.886 . . . . 0.0 111.364 179.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.619 ' CD1' ' HA ' ' A' ' 39' ' ' TRP . 3.6 t80 -75.25 -38.91 60.3 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.581 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.504 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 0.0 OUTLIER -53.99 -33.47 57.14 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-O 120.755 0.312 . . . . 0.0 111.338 -179.727 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -64.48 -25.85 68.18 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 120.973 0.416 . . . . 0.0 111.566 176.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 8.6 m -109.13 -30.45 8.03 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.807 -172.048 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.654 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -49.49 -56.92 13.7 Favored Pre-proline 0 CA--C 1.537 0.47 0 N-CA-C 113.536 0.939 . . . . 0.0 113.536 -174.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.654 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 43.5 Cg_endo -89.26 -9.8 4.18 Favored 'Trans proline' 0 N--CA 1.458 -0.597 0 C-N-CA 122.19 1.927 . . . . 0.0 113.042 -177.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -85.9 38.0 0.73 Allowed 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -170.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 64.9 m-85 -106.06 -8.76 17.34 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 110.254 -0.276 . . . . 0.0 110.254 175.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 66.24 150.84 0.05 Allowed 'General case' 0 N--CA 1.463 0.206 0 O-C-N 124.266 0.979 . . . . 0.0 112.094 -177.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.722 ' HA2' ' HB3' ' A' ' 114' ' ' ASN . . . -168.96 -123.53 0.68 Allowed Glycine 0 N--CA 1.442 -0.909 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.47 -177.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.552 ' H ' ' HE2' ' A' ' 116' ' ' TYR . 7.3 ttt85 -159.85 133.41 7.09 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.85 0.357 . . . . 0.0 110.185 -175.079 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.459 ' O ' ' HB2' ' A' ' 71' ' ' TRP . 75.4 mmtt -77.66 -25.64 49.75 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.12 -175.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 23.2 mt-10 -57.9 -52.91 63.56 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.873 -0.603 . . . . 0.0 111.315 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.678 HD12 HG12 ' A' ' 98' ' ' ILE . 0.1 OUTLIER -68.37 -23.13 27.96 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.71 -178.499 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.546 ' O ' ' HG3' ' A' ' 75' ' ' LYS . 1.8 m95 -50.99 -34.33 28.61 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 111.481 -178.324 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.751 ' HA ' ' HE2' ' A' ' 75' ' ' LYS . 17.2 t70 -56.89 -39.87 75.17 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.829 177.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.74 -27.08 60.99 Favored 'General case' 0 N--CA 1.453 -0.325 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.227 -177.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.512 HD11 ' SG ' ' A' ' 108' ' ' CYS . 24.6 mt -68.92 -43.65 74.71 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.836 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.751 ' HE2' ' HA ' ' A' ' 72' ' ' ASP . 8.4 mtmt -64.95 -46.3 82.16 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 178.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.508 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -57.74 -43.93 85.71 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.363 -0.835 . . . . 0.0 111.669 178.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.522 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -68.01 -52.31 37.07 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 120.98 -0.288 . . . . 0.0 110.725 178.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.488 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -50.0 -35.28 24.0 Favored 'General case' 0 C--O 1.218 -0.581 0 O-C-N 123.451 0.469 . . . . 0.0 110.462 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.508 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 21.4 t60 -60.68 -52.24 65.95 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.28 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.542 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -67.68 -52.53 36.84 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.705 177.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 25.1 t80 -51.31 -36.12 41.12 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.782 178.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.4 mt-10 -57.49 -39.22 75.99 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.183 0.516 . . . . 0.0 111.138 175.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.5 t -87.63 23.72 1.89 Allowed 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.214 -178.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 71.89 5.2 5.28 Favored 'General case' 0 N--CA 1.469 0.494 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.072 178.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.542 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 8.8 t0 -79.58 89.63 5.1 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.491 0.662 . . . . 0.0 110.418 -178.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . . . . . . . . . 56.8 m80 -70.74 -35.82 72.86 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.008 -179.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.577 ' HA ' HE21 ' A' ' 90' ' ' GLN . 9.4 pt-20 -70.22 -44.39 68.71 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.833 -170.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.448 ' O ' HG13 ' A' ' 92' ' ' ILE . 13.3 mt -60.65 -54.42 45.6 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.819 0.342 . . . . 0.0 111.316 178.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.499 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -59.71 -42.87 94.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.908 -174.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.577 HE21 ' HA ' ' A' ' 87' ' ' GLU . 25.8 pt20 -70.57 -32.89 70.46 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.5 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -77.68 -24.21 49.39 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.172 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.448 HG13 ' O ' ' A' ' 88' ' ' LEU . 41.2 mt -72.26 -57.7 6.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.646 -0.252 . . . . 0.0 110.391 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.504 ' CG2' HG22 ' A' ' 98' ' ' ILE . 9.6 mm -50.0 -57.49 2.21 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.275 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.839 174.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . 0.617 ' OD2' ' HB2' ' A' ' 29' ' ' ASN . 3.9 t70 -64.4 -31.53 72.78 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.852 -176.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -74.36 -10.21 81.88 Favored Glycine 0 N--CA 1.45 -0.399 0 C-N-CA 121.02 -0.61 . . . . 0.0 112.391 -178.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -95.5 -0.68 51.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 O-C-N 122.681 -0.305 . . . . 0.0 110.415 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 74.73 7.86 4.34 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 122.024 0.916 . . . . 0.0 109.071 -176.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.97 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -87.38 137.09 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.706 0 CA-C-N 114.455 -1.248 . . . . 0.0 108.74 172.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.701 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 40.1 p -120.37 166.09 14.01 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 120.2 -0.6 . . . . 0.0 111.218 -175.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.727 HD12 ' H ' ' A' ' 104' ' ' ALA . 1.6 tm? -149.47 101.44 3.3 Favored Pre-proline 0 N--CA 1.446 -0.658 0 CA-C-N 115.88 -0.6 . . . . 0.0 109.666 176.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.789 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 26.4 Cg_endo -61.39 -16.79 49.43 Favored 'Trans proline' 0 N--CA 1.475 0.405 0 C-N-CA 123.801 3.001 . . . . 0.0 113.871 -172.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.669 ' H ' HD13 ' A' ' 100' ' ' LEU . 56.3 m-70 -82.83 -18.69 39.54 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.06 178.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.776 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 80.01 9.98 86.08 Favored Glycine 0 N--CA 1.453 -0.193 0 C-N-CA 120.98 -0.628 . . . . 0.0 112.386 -176.223 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.727 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -98.84 148.2 24.16 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.259 0.552 . . . . 0.0 111.776 -173.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.539 HD13 ' O ' ' A' ' 105' ' ' LEU . 2.6 tm? -79.15 -17.67 54.56 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 174.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.85 HG22 HD13 ' A' ' 123' ' ' LEU . 52.4 p -87.57 21.18 2.62 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 114.636 -1.165 . . . . 0.0 112.019 -171.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.486 ' HB3' HD21 ' A' ' 100' ' ' LEU . 49.1 mt-10 -157.12 160.37 38.77 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.212 -1.033 . . . . 0.0 108.212 173.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.681 ' SG ' ' HB2' ' A' ' 116' ' ' TYR . 13.3 p -154.8 139.37 16.92 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.615 -0.434 . . . . 0.0 110.318 174.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.452 ' HD1' ' O ' ' A' ' 108' ' ' CYS . 11.8 m-30 -118.52 120.86 38.78 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.698 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.988 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 5.0 t70 -80.69 145.23 31.7 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.154 -0.93 . . . . 0.0 109.674 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -60.01 -22.28 62.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.868 -170.384 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 25.7 mt -77.71 -9.79 59.18 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.741 0.305 . . . . 0.0 111.251 178.183 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.18 28.65 4.31 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.882 -0.675 . . . . 0.0 112.311 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.988 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 60.7 m-80 -98.97 158.65 15.51 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.984 -0.127 . . . . 0.0 110.796 -179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 24.0 ttp180 -139.34 139.65 37.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.796 0.331 . . . . 0.0 111.467 -176.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . 0.681 ' HB2' ' SG ' ' A' ' 108' ' ' CYS . 27.6 m-85 -136.67 152.75 50.74 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.113 175.833 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.448 ' O ' ' HD3' ' A' ' 119' ' ' PRO . 10.2 mm100 -122.05 120.83 35.49 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.002 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.633 ' HB2' ' C ' ' A' ' 106' ' ' THR . 4.1 mm? -90.06 109.79 35.55 Favored Pre-proline 0 C--N 1.326 -0.451 0 CA-C-O 121.143 0.497 . . . . 0.0 111.512 -176.151 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.537 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 22.1 Cg_exo -74.74 156.09 44.18 Favored 'Trans proline' 0 CA--C 1.535 0.534 0 C-N-CA 124.152 3.235 . . . . 0.0 113.633 -179.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.99 HG22 ' HE1' ' A' ' 39' ' ' TRP . 4.9 m -63.63 -16.68 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 CA-C-N 114.735 -1.12 . . . . 0.0 113.178 -173.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.537 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.2 p90 -58.35 -23.54 57.14 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 112.546 0.573 . . . . 0.0 112.546 -169.618 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 39.4 t -129.84 27.35 5.2 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.096 0.474 . . . . 0.0 109.877 -179.087 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.85 HD13 HG22 ' A' ' 106' ' ' THR . 95.1 mt -138.27 -50.3 0.57 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.917 -176.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -135.08 111.5 11.03 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 120.962 0.41 . . . . 0.0 111.833 -175.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.655 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 31.6 Cg_exo -61.51 -43.57 26.8 Favored 'Trans proline' 0 CA--C 1.548 1.2 0 C-N-CA 123.545 2.83 . . . . 0.0 115.271 174.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.655 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 16.3 Cg_exo -29.68 -56.87 0.16 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 124.866 3.711 . . . . 0.0 115.63 -174.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.941 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -78.38 50.1 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.111 0.481 . . . . 0.0 111.853 -176.041 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 24.6 t-20 -94.89 -61.38 1.5 Allowed 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.673 -0.694 . . . . 0.0 111.561 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 26.7 ptt? -81.93 -37.12 27.25 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.014 0.375 . . . . 0.0 112.014 -175.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . . . . . . . . . 2.9 mp 66.78 -70.91 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 C-N-CA 123.093 0.557 . . . . 0.0 110.704 -174.159 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.768 ' HB2' HG13 ' A' ' 136' ' ' ILE . 28.2 mt-10 -74.85 165.7 24.82 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.932 0.396 . . . . 0.0 110.032 178.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -124.38 -151.6 0.48 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 -169.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.409 ' HE3' ' HB2' ' A' ' 133' ' ' LYS . 16.4 ptmt 57.7 12.13 1.52 Allowed 'General case' 0 N--CA 1.467 0.407 0 C-N-CA 125.347 1.459 . . . . 0.0 113.779 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 19.3 m 54.11 39.52 30.75 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.542 175.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -110.57 -36.41 5.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.257 0.551 . . . . 0.0 110.988 -177.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.768 HG13 ' HB2' ' A' ' 131' ' ' GLU . 22.1 mm -73.14 -98.18 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 115.254 -0.884 . . . . 0.0 112.769 -171.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.466 ' HG2' HG22 ' A' ' 136' ' ' ILE . 8.4 mm-40 -90.67 49.04 1.61 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.0 0.429 . . . . 0.0 111.319 -176.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 21.5 m -97.82 62.67 1.63 Allowed 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.67 0.747 . . . . 0.0 109.984 178.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 21.7 tp -128.36 103.72 7.31 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.194 -0.912 . . . . 0.0 109.129 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 10.7 m-20 -108.26 -46.12 3.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.555 -171.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 22.1 pt . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.043 -0.98 . . . . 0.0 110.85 -179.02 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.8 m . . . . . 0 N--CA 1.476 0.873 0 CA-C-O 120.961 0.41 . . . . 0.0 110.294 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 95.8 mt -120.37 104.63 10.17 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.1 0.476 . . . . 0.0 110.84 -178.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 92.9 m-20 -92.25 65.58 4.65 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 178.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -85.5 -60.84 1.91 Allowed 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.204 -170.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.6 p30 -78.91 -156.1 0.1 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.051 0.389 . . . . 0.0 112.051 -174.076 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.8 m -73.64 21.6 0.08 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -176.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -131.24 87.62 2.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.021 0.438 . . . . 0.0 110.596 175.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -115.85 -2.18 20.73 Favored Glycine 0 N--CA 1.449 -0.468 0 N-CA-C 111.364 -0.695 . . . . 0.0 111.364 175.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 9.8 t -168.68 48.9 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.781 0.8 . . . . 0.0 109.596 -177.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 89.8 -62.11 3.36 Favored Glycine 0 N--CA 1.451 -0.332 0 N-CA-C 110.057 -1.217 . . . . 0.0 110.057 -171.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.774 HG12 ' H ' ' A' ' 25' ' ' ALA . 10.4 t -120.85 -137.41 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 167.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.774 ' H ' HG12 ' A' ' 24' ' ' VAL . . . -148.04 -76.97 0.17 Allowed 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 176.508 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.883 HD21 ' HB2' ' A' ' 101' ' ' PRO . 0.0 OUTLIER -106.54 -21.98 12.9 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.599 177.887 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.43 ' N ' HD13 ' A' ' 26' ' ' LEU . . . 139.41 111.75 0.98 Allowed Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.416 -0.897 . . . . 0.0 113.383 175.793 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.507 ' HG2' ' CG1' ' A' ' 24' ' ' VAL . 24.1 mmt180 -56.87 -73.32 0.07 Allowed 'General case' 0 C--O 1.233 0.214 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 172.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.522 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 31.0 p-10 -99.31 159.61 14.88 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.851 -172.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.624 ' CD ' ' H ' ' A' ' 30' ' ' GLN . 0.0 OUTLIER -84.37 110.27 25.52 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 115.22 -0.9 . . . . 0.0 113.229 -165.149 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.566 ' HD2' ' CA ' ' A' ' 103' ' ' GLY . 12.6 Cg_exo -70.75 -162.91 0.11 Allowed 'Trans proline' 0 C--N 1.349 0.562 0 C-N-CA 124.056 3.171 . . . . 0.0 112.666 174.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.684 ' H ' HD12 ' A' ' 32' ' ' LEU . 6.5 mp -41.52 139.25 1.15 Allowed 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.408 0.683 . . . . 0.0 112.798 -178.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.981 ' HE2' ' HG2' ' A' ' 90' ' ' GLN . 2.3 mptp? -89.8 74.45 7.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.659 -0.701 . . . . 0.0 110.629 -176.039 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.92 -15.4 19.17 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.446 177.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.41 ' HB3' ' HB2' ' A' ' 104' ' ' ALA . 19.9 tt0 -77.03 156.91 31.48 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.491 0.662 . . . . 0.0 111.008 -178.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.425 ' H ' ' HG2' ' A' ' 36' ' ' LYS . 8.5 pttt -94.97 159.23 33.57 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.038 -172.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.554 ' HB2' HG12 ' A' ' 120' ' ' VAL . 12.2 Cg_exo -68.86 144.83 60.34 Favored 'Trans proline' 0 C--N 1.35 0.611 0 C-N-CA 122.055 1.837 . . . . 0.0 111.296 174.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.699 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 31.9 ttpt -111.04 145.19 38.93 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.303 -170.957 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 1.051 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.0 OUTLIER 134.75 -9.25 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.237 0 O-C-N 125.429 1.706 . . . . 0.0 109.775 -179.348 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.614 ' HG2' HG11 ' A' ' 120' ' ' VAL . 0.0 OUTLIER -113.61 168.89 9.38 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-O 121.386 0.612 . . . . 0.0 111.396 -171.049 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 19.2 m -85.82 133.13 33.99 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.287 -176.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -68.3 -27.85 66.66 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.444 0.64 . . . . 0.0 109.338 175.165 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 52.1 t80 -141.43 84.4 12.55 Favored Pre-proline 0 C--N 1.323 -0.568 0 CA-C-N 114.854 -1.067 . . . . 0.0 108.892 175.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -68.49 144.36 60.83 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 122.825 2.35 . . . . 0.0 111.805 -178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.598 ' O ' HG22 ' A' ' 130' ' ' ILE . 0.0 OUTLIER -127.21 -135.25 0.24 Allowed 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.279 179.703 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.818 HG22 HD12 ' A' ' 136' ' ' ILE . 69.0 p -73.1 170.05 15.73 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 112.311 0.486 . . . . 0.0 112.311 -171.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 20.4 t70 -55.15 -37.88 67.53 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.617 -177.474 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -55.44 -36.59 63.97 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.85 -0.691 . . . . 0.0 112.109 177.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -75.42 -39.16 59.3 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 176.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.75 ' HB2' HG21 ' A' ' 130' ' ' ILE . 54.8 tp -58.66 -53.18 61.28 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.903 178.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.461 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 16.4 ptp180 -60.72 -46.83 88.9 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.082 -178.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 18.2 m -65.2 -47.66 76.14 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.531 -0.304 . . . . 0.0 110.947 -178.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.594 ' C ' ' HD2' ' A' ' 53' ' ' LYS . 4.5 tmmm? -56.95 -45.75 82.59 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.135 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 29.3 ttt180 -53.5 -53.47 50.99 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.429 -174.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -69.1 -50.4 48.48 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-O 121.051 0.453 . . . . 0.0 111.147 -177.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.488 ' O ' ' HB3' ' A' ' 59' ' ' ASP . 1.7 tm-20 -54.56 -49.87 69.29 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.041 -0.981 . . . . 0.0 110.836 -177.549 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.411 ' CE1' ' HG2' ' A' ' 53' ' ' LYS . 12.1 m-85 -71.48 -39.05 71.13 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.622 -179.058 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.493 ' HA ' ' CE3' ' A' ' 58' ' ' TRP . 1.9 m95 -56.91 -23.08 42.36 Favored 'General case' 0 N--CA 1.468 0.455 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 176.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.488 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 7.5 t70 -65.9 -37.24 85.58 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 120.858 0.361 . . . . 0.0 111.351 173.519 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 4.2 m -107.91 -22.08 12.58 Favored 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -169.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.598 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -60.46 -59.19 14.63 Favored Pre-proline 0 CA--C 1.538 0.512 0 N-CA-C 112.88 0.696 . . . . 0.0 112.88 -179.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.598 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 88.0 Cg_endo -78.41 -8.06 16.07 Favored 'Trans proline' 0 C--N 1.349 0.56 0 C-N-CA 122.073 1.849 . . . . 0.0 112.953 -174.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 67.17 -150.79 0.18 Allowed 'General case' 0 N--CA 1.463 0.2 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.166 178.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -88.37 -43.38 11.55 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.04 0.448 . . . . 0.0 110.41 -176.483 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -179.19 -175.87 0.39 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.072 -178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.436 ' HA3' ' CZ ' ' A' ' 116' ' ' TYR . . . -162.81 -168.52 24.87 Favored Glycine 0 N--CA 1.44 -1.073 0 N-CA-C 111.421 -0.672 . . . . 0.0 111.421 175.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 67' ' ' ARG . 68.6 mmt-85 -102.9 116.69 33.03 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 109.199 -0.667 . . . . 0.0 109.199 174.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.411 ' HD2' ' OE1' ' A' ' 69' ' ' GLU . 0.0 OUTLIER -77.63 -15.92 58.88 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.776 0.322 . . . . 0.0 110.807 -177.668 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.411 ' OE1' ' HD2' ' A' ' 68' ' ' LYS . 6.8 mp0 -60.57 -41.98 95.7 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.244 175.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.563 ' O ' HG12 ' A' ' 70' ' ' ILE . 0.3 OUTLIER -82.98 -19.84 9.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.36 179.32 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.52 ' O ' ' HG2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -46.57 -41.42 14.41 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 122.569 0.348 . . . . 0.0 111.891 -176.241 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.504 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 10.4 m-20 -59.8 -32.63 70.81 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.702 -178.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -73.18 -35.15 66.34 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.09 0.471 . . . . 0.0 109.919 178.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.419 HD21 HD13 ' A' ' 70' ' ' ILE . 25.4 mt -66.22 -48.65 69.89 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.594 -178.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.52 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 14.3 ptpt -68.78 -28.03 66.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.408 -0.815 . . . . 0.0 110.855 179.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.414 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -73.2 -36.9 66.6 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.916 0.388 . . . . 0.0 110.672 176.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . . . . . . . . . . . -68.67 -48.0 65.06 Favored 'General case' 0 CA--C 1.512 -0.516 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.475 176.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.51 ' HA ' HD11 ' A' ' 105' ' ' LEU . . . -52.76 -34.3 52.41 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.826 172.055 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.414 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 35.4 t60 -64.4 -51.9 60.88 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.948 0.404 . . . . 0.0 109.929 178.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.438 ' HB1' ' HB2' ' A' ' 88' ' ' LEU . . . -64.1 -55.56 21.14 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.689 -0.687 . . . . 0.0 111.187 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -52.68 -34.81 53.64 Favored 'General case' 0 CA--C 1.537 0.462 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.642 179.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -68.46 -31.94 71.59 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 121.012 0.434 . . . . 0.0 111.395 176.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.441 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 7.1 t -85.31 15.55 4.27 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 177.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.441 ' HB2' ' O ' ' A' ' 83' ' ' SER . 36.3 m-80 73.6 5.18 4.89 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.163 -0.926 . . . . 0.0 111.589 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.401 ' HB2' ' O ' ' A' ' 80' ' ' ALA . 1.7 m-20 -77.21 84.62 3.68 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.859 0.837 . . . . 0.0 110.584 176.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.662 ' HE2' ' HA ' ' A' ' 32' ' ' LEU . 12.6 t-80 -70.36 -39.59 74.53 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.67 -1.15 . . . . 0.0 110.256 179.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -60.28 -44.0 95.73 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.387 -178.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.441 ' O ' HG13 ' A' ' 92' ' ' ILE . 12.7 mt -63.71 -51.48 64.82 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.736 -177.425 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.588 ' O ' HG12 ' A' ' 93' ' ' ILE . . . -60.55 -39.29 87.4 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.605 -175.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.981 ' HG2' ' HE2' ' A' ' 33' ' ' LYS . 9.2 mt-30 -65.46 -43.67 89.61 Favored 'General case' 0 C--N 1.326 -0.432 0 C-N-CA 120.581 -0.448 . . . . 0.0 110.705 176.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.74 -21.17 64.39 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.029 -177.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.441 HG13 ' O ' ' A' ' 88' ' ' LEU . 54.4 mt -82.12 -60.94 1.92 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.57 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.505 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 89' ' ' ALA . 9.3 mm -55.23 -54.34 25.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-O 120.829 0.347 . . . . 0.0 111.253 178.612 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -66.48 -33.19 75.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.273 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -69.97 -14.44 70.72 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.756 -0.735 . . . . 0.0 112.225 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.425 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -95.99 3.72 53.24 Favored 'General case' 0 N--CA 1.452 -0.346 0 N-CA-C 110.628 -0.138 . . . . 0.0 110.628 179.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.425 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 84.5 m-20 75.89 7.6 3.69 Favored 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.688 0.617 . . . . 0.0 109.621 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.915 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.4 mp -89.94 139.47 17.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 115.036 -0.984 . . . . 0.0 109.831 179.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 19.7 p -124.26 162.74 23.09 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.222 0.535 . . . . 0.0 111.619 -176.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.72 HD13 ' H ' ' A' ' 102' ' ' HIS . 1.7 tm? -150.1 109.83 3.25 Favored Pre-proline 0 N--CA 1.446 -0.672 0 CA-C-N 115.32 -0.855 . . . . 0.0 109.463 176.776 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.883 ' HB2' HD21 ' A' ' 26' ' ' LEU . 38.0 Cg_endo -64.71 -24.01 62.61 Favored 'Trans proline' 0 CA--C 1.535 0.528 0 C-N-CA 123.185 2.59 . . . . 0.0 113.655 -172.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.72 ' H ' HD13 ' A' ' 100' ' ' LEU . 11.3 m170 -76.29 -18.75 58.81 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.784 0.325 . . . . 0.0 111.283 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.566 ' CA ' ' HD2' ' A' ' 31' ' ' PRO . . . 80.51 11.68 83.84 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.579 -0.819 . . . . 0.0 112.702 -176.088 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.581 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -93.29 152.02 19.43 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.297 0.57 . . . . 0.0 111.56 -173.439 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.885 ' HB2' ' HG2' ' A' ' 33' ' ' LYS . 2.8 tm? -84.89 -23.36 28.96 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 114.815 -1.084 . . . . 0.0 108.209 174.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.443 HG21 ' HG3' ' A' ' 37' ' ' PRO . 47.0 p -88.46 17.62 5.19 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.635 -1.166 . . . . 0.0 111.53 -174.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.604 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 66.4 mt-10 -150.5 143.21 24.57 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 81.8 m -152.01 139.24 19.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-O 120.886 0.374 . . . . 0.0 111.519 176.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.559 ' HE1' ' HG3' ' A' ' 115' ' ' ARG . 19.7 m-30 -118.94 122.02 41.27 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.469 0.652 . . . . 0.0 109.46 177.44 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.965 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.9 t70 -83.32 145.42 29.08 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 114.224 -1.353 . . . . 0.0 110.009 -178.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -56.89 -27.49 60.68 Favored 'General case' 0 C--N 1.331 -0.233 0 O-C-N 124.451 1.095 . . . . 0.0 112.271 -169.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 24.0 mt -76.47 -11.91 59.96 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.453 -177.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 109.66 30.22 3.6 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 121.015 -0.612 . . . . 0.0 112.253 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.965 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 57.3 m-80 -98.76 157.92 15.96 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.744 0.307 . . . . 0.0 110.952 -179.183 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.559 ' HG3' ' HE1' ' A' ' 109' ' ' TYR . 11.4 ttm180 -134.53 122.53 22.54 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.938 -174.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . 0.436 ' CZ ' ' HA3' ' A' ' 66' ' ' GLY . 38.5 m-85 -120.85 124.8 45.9 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.375 175.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 4.0 mm100 -122.34 121.37 36.55 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 -177.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.489 HD23 HD11 ' A' ' 123' ' ' LEU . 21.5 tp -98.65 122.2 53.98 Favored Pre-proline 0 C--N 1.324 -0.532 0 N-CA-C 112.331 0.493 . . . . 0.0 112.331 -166.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.568 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 11.2 Cg_exo -74.84 157.38 43.47 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 123.974 3.116 . . . . 0.0 113.215 177.715 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.051 HG22 ' HE1' ' A' ' 39' ' ' TRP . 20.4 m -72.58 -10.03 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.566 0 CA-C-N 115.536 -0.756 . . . . 0.0 112.798 -175.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.568 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 6.1 p90 -56.24 -24.11 40.35 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -170.407 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 52.2 t -113.4 3.53 15.89 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.74 0.305 . . . . 0.0 111.111 -176.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.489 HD11 HD23 ' A' ' 118' ' ' LEU . 20.0 mt -125.47 -53.61 1.58 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.848 0.356 . . . . 0.0 111.842 -174.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.623 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -136.15 111.59 10.13 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.691 0.281 . . . . 0.0 110.764 -176.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.511 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 11.1 Cg_endo -92.78 6.7 3.07 Favored 'Trans proline' 0 CA--C 1.559 1.764 0 C-N-CA 123.281 2.654 . . . . 0.0 117.379 -179.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.623 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 17.4 Cg_endo -59.29 -31.57 95.32 Favored 'Trans proline' 0 C--N 1.37 1.71 0 CA-C-N 122.921 2.079 . . . . 0.0 111.776 174.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.694 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.1 OUTLIER -91.79 39.88 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.091 178.642 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . 0.411 HD22 ' C ' ' A' ' 128' ' ' ASN . 0.2 OUTLIER -109.13 -31.07 7.74 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.534 176.613 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 16.2 tpt -65.36 -42.94 92.25 Favored 'General case' 0 N--CA 1.455 -0.213 0 CA-C-O 120.963 0.411 . . . . 0.0 110.218 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.75 HG21 ' HB2' ' A' ' 50' ' ' LEU . 20.7 mm 73.26 -69.37 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 CA-C-N 115.157 -0.928 . . . . 0.0 111.824 175.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 1.033 ' HB3' HG13 ' A' ' 136' ' ' ILE . 9.7 mt-10 -81.61 -172.3 3.78 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.226 -0.897 . . . . 0.0 111.406 -171.211 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.43 ' HB3' ' HD3' ' A' ' 133' ' ' LYS . 34.7 mt-10 -69.02 -175.62 0.76 Allowed 'General case' 0 C--N 1.332 -0.184 0 N-CA-C 112.19 0.441 . . . . 0.0 112.19 -178.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.507 ' HD3' ' H ' ' A' ' 133' ' ' LYS . 0.0 OUTLIER -52.13 -44.79 64.69 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.459 -176.92 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . 0.406 ' N ' ' HG2' ' A' ' 133' ' ' LYS . 8.7 t 177.14 34.89 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.511 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -92.34 -21.83 20.04 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.019 -0.991 . . . . 0.0 109.615 -171.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 1.033 HG13 ' HB3' ' A' ' 131' ' ' GLU . 3.4 mm -82.38 157.75 3.94 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.405 -1.27 . . . . 0.0 110.871 -174.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.421 ' H ' ' CD ' ' A' ' 137' ' ' GLU . 14.0 mp0 -71.99 -17.75 62.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.9 -176.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -73.17 109.85 7.01 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 116.207 -0.452 . . . . 0.0 110.742 -177.339 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 23.2 tp -131.64 -65.75 0.75 Allowed 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.882 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -93.18 -47.25 7.03 Favored 'General case' 0 CA--C 1.511 -0.544 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 5.0 pt . . . . . 0 C--N 1.319 -0.752 0 CA-C-N 114.753 -1.112 . . . . 0.0 110.868 179.494 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 18.6 t . . . . . 0 N--CA 1.477 0.88 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 91.9 mt 63.89 95.3 0.05 OUTLIER 'General case' 0 C--O 1.235 0.3 0 O-C-N 123.513 0.508 . . . . 0.0 111.175 -177.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.64 ' OD1' ' HA ' ' A' ' 19' ' ' SER . 66.0 t30 -74.28 61.36 0.88 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.682 179.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -79.82 -44.71 20.05 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.4 t-20 -97.31 102.43 14.2 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 107.956 -1.128 . . . . 0.0 107.956 166.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.64 ' HA ' ' OD1' ' A' ' 16' ' ' ASN . 23.2 t -61.71 134.34 56.66 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.217 -173.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.4 ' HB3' HG22 ' A' ' 22' ' ' THR . 43.2 tt0 -91.0 147.27 23.2 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.771 178.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -57.18 -8.45 3.38 Favored Glycine 0 C--N 1.335 0.486 0 CA-C-N 115.621 -0.718 . . . . 0.0 114.395 -175.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.4 HG22 ' HB3' ' A' ' 20' ' ' GLU . 8.6 t -59.19 -31.25 68.84 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.147 0.499 . . . . 0.0 110.174 172.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -113.76 -47.06 0.64 Allowed Glycine 0 N--CA 1.447 -0.577 0 N-CA-C 110.723 -0.951 . . . . 0.0 110.723 174.4 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.733 HG11 ' H ' ' A' ' 28' ' ' ARG . 4.6 p 176.86 159.32 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.436 -1.146 0 N-CA-C 107.15 -1.426 . . . . 0.0 107.15 177.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.502 ' O ' ' HB3' ' A' ' 19' ' ' SER . . . -86.31 -82.47 0.2 Allowed 'General case' 0 C--N 1.297 -1.685 0 C-N-CA 120.33 -0.548 . . . . 0.0 112.002 179.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.809 HD13 ' H ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -76.88 -18.9 58.04 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.095 -0.502 . . . . 0.0 112.258 -174.937 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.536 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 127.15 104.31 1.29 Allowed Glycine 0 C--O 1.221 -0.688 0 C-N-CA 120.45 -0.881 . . . . 0.0 112.247 178.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.733 ' H ' HG11 ' A' ' 24' ' ' VAL . 0.0 OUTLIER -76.63 -19.63 57.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.039 0.447 . . . . 0.0 111.231 178.817 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.493 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 22.1 p-10 -101.08 157.96 16.37 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.349 176.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.788 ' HB3' ' HA2' ' A' ' 103' ' ' GLY . 0.0 OUTLIER -87.19 117.67 68.92 Favored Pre-proline 0 C--N 1.324 -0.542 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -168.829 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.784 ' HD2' ' HA3' ' A' ' 103' ' ' GLY . 13.4 Cg_exo -72.17 -163.4 0.14 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 123.227 2.618 . . . . 0.0 111.476 164.833 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.455 ' HA ' ' NE2' ' A' ' 86' ' ' HIS . 7.2 mp -59.99 142.86 53.11 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.808 0.337 . . . . 0.0 110.985 178.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.552 ' HE3' ' HB2' ' A' ' 86' ' ' HIS . 0.0 OUTLIER -78.02 71.98 4.52 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-O 121.274 0.559 . . . . 0.0 111.586 -178.993 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -87.29 -17.3 32.82 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.547 -179.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -80.27 169.56 17.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.528 0.68 . . . . 0.0 111.729 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.2 pttt -108.62 149.72 39.8 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 114.792 -1.095 . . . . 0.0 110.215 -176.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.614 ' HG3' HG21 ' A' ' 106' ' ' THR . 22.9 Cg_exo -60.8 138.75 81.35 Favored 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.566 2.177 . . . . 0.0 111.665 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.506 ' HE2' ' HB3' ' A' ' 38' ' ' LYS . 3.4 tmmm? -111.17 122.47 47.96 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.891 0.853 . . . . 0.0 112.761 -170.49 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 1.047 ' HE1' HG22 ' A' ' 120' ' ' VAL . 1.9 p-90 175.04 23.26 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 113.058 -1.883 . . . . 0.0 108.159 172.491 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.601 ' HE2' HG12 ' A' ' 127' ' ' ILE . 1.8 tmmt? -142.24 149.55 39.76 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.444 -156.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.502 ' O ' ' HD2' ' A' ' 40' ' ' LYS . 57.7 m -66.75 119.64 12.16 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.373 178.23 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -64.54 -25.56 68.04 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 38.4 t80 -130.16 83.6 62.66 Favored Pre-proline 0 C--N 1.326 -0.448 0 CA-C-N 115.427 -0.806 . . . . 0.0 109.592 171.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.578 ' HB2' HG12 ' A' ' 130' ' ' ILE . 16.8 Cg_exo -70.03 141.38 43.96 Favored 'Trans proline' 0 C--O 1.231 0.147 0 C-N-CA 122.636 2.224 . . . . 0.0 112.35 -178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . . . . . . . . . 85.7 mtp -116.75 -135.63 0.35 Allowed 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.439 179.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.572 ' CG2' HG21 ' A' ' 136' ' ' ILE . 37.3 p -72.93 -179.88 3.4 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -171.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.595 ' OD1' ' HB ' ' A' ' 136' ' ' ILE . 9.7 p-10 -65.68 -37.19 85.79 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.737 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.8 -38.82 96.71 Favored Glycine 0 N--CA 1.449 -0.481 0 C-N-CA 121.026 -0.607 . . . . 0.0 111.633 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.884 HE21 ' HA ' ' A' ' 49' ' ' GLN . 0.0 OUTLIER -71.68 -33.55 68.93 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 176.612 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.698 ' O ' ' HB2' ' A' ' 54' ' ' ARG . 3.2 tm? -60.49 -52.7 64.08 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.322 178.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.48 ' HG3' ' N ' ' A' ' 52' ' ' SER . 6.6 ptm180 -65.1 -54.9 22.78 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 111.891 0.33 . . . . 0.0 111.891 -176.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.48 ' N ' ' HG3' ' A' ' 51' ' ' ARG . 47.7 m -62.75 -50.9 69.26 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.421 -174.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.468 ' O ' ' HD2' ' A' ' 57' ' ' PHE . 0.1 OUTLIER -67.94 -28.37 67.41 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.903 -177.718 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.698 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER -63.2 -39.48 94.75 Favored 'General case' 0 CA--C 1.518 -0.273 0 N-CA-C 110.111 -0.329 . . . . 0.0 110.111 178.801 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -67.82 -48.32 66.56 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.243 179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -51.03 -52.41 43.32 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.992 174.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.468 ' HD2' ' O ' ' A' ' 53' ' ' LYS . 17.8 m-85 -59.97 -40.04 87.69 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.531 177.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 0.4 OUTLIER -58.33 -25.0 61.41 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 112.294 0.479 . . . . 0.0 112.294 178.019 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -73.72 -32.47 63.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.115 0.483 . . . . 0.0 110.859 173.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 9.0 m -92.32 -23.43 19.26 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.324 -174.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.682 ' HB3' ' HD3' ' A' ' 62' ' ' PRO . . . -59.98 -67.02 1.15 Allowed Pre-proline 0 CA--C 1.539 0.547 0 N-CA-C 112.466 0.543 . . . . 0.0 112.466 -175.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.682 ' HD3' ' HB3' ' A' ' 61' ' ' ALA . 88.8 Cg_endo -77.86 -37.25 0.91 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 121.52 1.48 . . . . 0.0 112.462 -175.16 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 58.36 -90.15 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 171.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 58.6 m-85 -107.76 -7.52 16.33 Favored 'General case' 0 C--O 1.234 0.261 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -168.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 59.17 -158.46 0.31 Allowed 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.758 0.314 . . . . 0.0 110.187 -174.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . 0.506 ' HA3' ' HB3' ' A' ' 114' ' ' ASN . . . 179.75 -138.46 3.44 Favored Glycine 0 N--CA 1.444 -0.794 0 C-N-CA 120.538 -0.839 . . . . 0.0 112.786 177.306 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.688 ' HB3' HG22 ' A' ' 70' ' ' ILE . 7.7 tpt180 -81.12 112.75 18.77 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -179.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.567 ' HD2' ' HD1' ' A' ' 71' ' ' TRP . 14.3 tptm -61.57 -33.02 73.15 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 120.915 0.388 . . . . 0.0 110.584 175.06 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -56.72 -45.18 82.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.62 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.688 HG22 ' HB3' ' A' ' 67' ' ' ARG . 0.5 OUTLIER -77.27 -21.18 14.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.198 -177.507 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.567 ' HD1' ' HD2' ' A' ' 68' ' ' LYS . 0.0 OUTLIER -47.32 -42.92 22.23 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-O 121.28 0.562 . . . . 0.0 111.208 -176.563 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . 0.549 ' HA ' ' HD2' ' A' ' 75' ' ' LYS . 7.9 m-20 -66.04 -25.57 67.11 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.894 -178.385 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -78.6 -29.78 46.23 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.4 0.619 . . . . 0.0 109.525 179.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.419 HD21 ' CD1' ' A' ' 70' ' ' ILE . 17.2 mt -70.19 -51.2 32.92 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.506 -179.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.549 ' HD2' ' HA ' ' A' ' 72' ' ' ASP . 13.2 ptpt -64.89 -32.74 74.59 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.867 178.459 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.429 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -70.26 -35.57 73.88 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-O 120.752 0.311 . . . . 0.0 110.945 176.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.593 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -68.87 -46.91 67.24 Favored 'General case' 0 CA--C 1.513 -0.463 0 CA-C-N 116.561 -0.29 . . . . 0.0 110.484 176.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.572 ' HB1' HD21 ' A' ' 123' ' ' LEU . . . -52.59 -36.02 55.33 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.419 173.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.526 ' O ' ' HB2' ' A' ' 82' ' ' GLU . 63.6 t60 -62.98 -47.09 84.65 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.342 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.06 -51.32 59.26 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.56 178.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.551 ' CD2' ' HG ' ' A' ' 105' ' ' LEU . 1.8 t80 -54.04 -34.7 60.72 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.891 178.174 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.538 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 28.6 mt-10 -51.37 -48.72 62.43 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.908 0.385 . . . . 0.0 111.482 175.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.561 ' O ' ' HB2' ' A' ' 84' ' ' ASN . 15.2 m -76.41 -19.69 57.85 Favored 'General case' 0 N--CA 1.451 -0.406 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.731 -173.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.561 ' HB2' ' O ' ' A' ' 83' ' ' SER . 9.7 t30 138.93 -17.32 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.226 0 O-C-N 124.947 1.405 . . . . 0.0 109.846 -179.65 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.589 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 0.2 OUTLIER -71.73 90.63 1.08 Allowed 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.106 0.78 . . . . 0.0 113.106 -165.106 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.704 ' O ' ' HG2' ' A' ' 90' ' ' GLN . 27.4 t-80 -70.45 -44.99 66.66 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.302 -0.863 . . . . 0.0 109.011 170.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . 0.508 ' H ' ' CD ' ' A' ' 87' ' ' GLU . 1.7 pm0 -62.96 -47.03 84.94 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.525 -0.761 . . . . 0.0 111.73 -172.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.525 ' O ' HG13 ' A' ' 92' ' ' ILE . 4.2 mt -54.45 -56.36 19.52 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-O 121.251 0.548 . . . . 0.0 110.838 177.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.795 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -61.31 -42.64 99.01 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.766 -174.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.704 ' HG2' ' O ' ' A' ' 86' ' ' HIS . 22.6 mm-40 -63.74 -38.45 91.14 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 121.171 -0.211 . . . . 0.0 111.18 178.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.77 -30.77 69.44 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.906 0.384 . . . . 0.0 110.284 179.45 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.525 HG13 ' O ' ' A' ' 88' ' ' LEU . 57.2 mt -69.71 -59.97 2.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.851 178.084 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.567 HG12 ' O ' ' A' ' 89' ' ' ALA . 8.5 mm -52.4 -57.17 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.344 0 CA-C-O 121.134 0.492 . . . . 0.0 111.005 178.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -64.56 -24.49 67.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.042 -176.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.57 -19.2 68.78 Favored Glycine 0 N--CA 1.45 -0.368 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.697 -177.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.43 ' O ' ' HB2' ' A' ' 97' ' ' ASN . . . -101.53 4.24 40.89 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 122.692 -0.299 . . . . 0.0 110.603 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 96' ' ' ALA . 3.7 m-20 72.9 8.11 5.46 Favored 'General case' 0 N--CA 1.472 0.655 0 CA-C-O 121.565 0.698 . . . . 0.0 110.107 -174.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.968 HG13 ' HA ' ' A' ' 110' ' ' ASP . 1.6 mp -82.05 136.92 22.03 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-N 114.919 -1.037 . . . . 0.0 108.82 173.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.521 ' HA ' ' OE1' ' A' ' 30' ' ' GLN . 25.6 p -138.61 171.18 14.73 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 120.647 -0.421 . . . . 0.0 111.409 -177.345 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.784 HD13 ' H ' ' A' ' 102' ' ' HIS . 1.5 tm? -148.52 114.33 3.8 Favored Pre-proline 0 N--CA 1.448 -0.537 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.935 179.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.582 ' HD2' HD22 ' A' ' 100' ' ' LEU . 34.7 Cg_endo -65.13 -17.62 59.32 Favored 'Trans proline' 0 CA--C 1.536 0.621 0 C-N-CA 123.492 2.795 . . . . 0.0 114.558 -174.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.784 ' H ' HD13 ' A' ' 100' ' ' LEU . 18.8 m-70 -79.93 -23.22 41.88 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.179 0.514 . . . . 0.0 111.033 177.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.788 ' HA2' ' HB3' ' A' ' 30' ' ' GLN . . . 75.99 17.29 80.12 Favored Glycine 0 N--CA 1.443 -0.877 0 C-N-CA 120.392 -0.909 . . . . 0.0 111.567 -172.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -94.96 141.38 28.72 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-O 121.168 0.509 . . . . 0.0 110.406 -176.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.795 HD21 ' HB1' ' A' ' 89' ' ' ALA . 0.3 OUTLIER -75.29 -21.63 58.34 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 114.9 -1.046 . . . . 0.0 109.005 179.122 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.614 HG21 ' HG3' ' A' ' 37' ' ' PRO . 64.4 p -90.71 15.05 11.81 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.936 -173.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.585 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.4 mt-10 -148.55 143.87 26.91 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 108.458 -0.942 . . . . 0.0 108.458 175.034 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.8 m -150.75 139.17 20.42 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.524 0.202 . . . . 0.0 110.523 175.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 19.9 m-30 -118.92 123.16 43.96 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.343 0.592 . . . . 0.0 109.967 179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 0.968 ' HA ' HG13 ' A' ' 98' ' ' ILE . 9.3 t70 -87.11 147.22 25.74 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.684 -1.144 . . . . 0.0 109.503 -178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -57.55 -24.71 57.63 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-N 115.359 -0.837 . . . . 0.0 112.112 -172.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.4 ' HG ' ' OD1' ' A' ' 110' ' ' ASP . 27.4 mt -76.71 -3.04 35.99 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.079 0.466 . . . . 0.0 110.938 -178.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 94.11 34.39 6.48 Favored Glycine 0 N--CA 1.444 -0.794 0 N-CA-C 111.255 -0.738 . . . . 0.0 111.255 -179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 0.787 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 11.6 m120 -106.6 157.88 17.35 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 109.86 -0.422 . . . . 0.0 109.86 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 17.9 ptp180 -139.95 139.16 36.06 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.229 0.537 . . . . 0.0 110.942 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . 0.424 ' O ' ' HA ' ' A' ' 107' ' ' GLU . 40.1 m-85 -124.91 127.75 47.57 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.921 175.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -121.38 122.52 40.01 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 -176.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.456 ' HA ' ' HD3' ' A' ' 119' ' ' PRO . 30.8 tp -102.53 123.29 43.28 Favored Pre-proline 0 C--N 1.32 -0.679 0 CA-C-N 115.893 -0.594 . . . . 0.0 112.065 -167.915 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.653 ' HB2' ' HD1' ' A' ' 121' ' ' TYR . 20.4 Cg_exo -69.48 155.76 65.94 Favored 'Trans proline' 0 CA--C 1.533 0.427 0 C-N-CA 123.737 2.958 . . . . 0.0 112.751 176.138 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 1.047 HG22 ' HE1' ' A' ' 39' ' ' TRP . 20.2 m -66.17 -17.71 22.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.152 -0.931 . . . . 0.0 112.656 -175.167 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.653 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 5.3 p90 -60.65 -22.14 63.53 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -166.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 43.7 t -110.59 1.48 18.1 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.957 -0.297 . . . . 0.0 111.601 -174.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.572 HD21 ' HB1' ' A' ' 78' ' ' ALA . 90.3 mt -130.31 -37.02 1.45 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.976 0.417 . . . . 0.0 111.808 -177.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.427 ' HB3' ' HB ' ' A' ' 120' ' ' VAL . . . -117.46 112.53 39.19 Favored Pre-proline 0 C--N 1.32 -0.695 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.439 -175.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.552 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 51.3 Cg_exo -56.38 -34.91 95.51 Favored 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.648 2.899 . . . . 0.0 115.674 177.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.552 ' HD2' ' N ' ' A' ' 125' ' ' PRO . 48.8 Cg_endo -67.31 -149.15 0.02 OUTLIER 'Trans proline' 0 C--N 1.365 1.444 0 C-N-CA 121.778 1.652 . . . . 0.0 112.459 175.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.601 HG12 ' HE2' ' A' ' 40' ' ' LYS . 4.0 mp 52.93 52.63 0.38 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.146 0 CA-C-O 122.383 1.087 . . . . 0.0 109.759 -174.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -147.68 106.59 3.84 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.549 -1.205 . . . . 0.0 109.002 -175.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 51.8 ttp 69.21 111.3 0.05 OUTLIER 'General case' 0 C--N 1.331 -0.221 0 O-C-N 124.069 0.856 . . . . 0.0 111.159 -179.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.578 HG12 ' HB2' ' A' ' 44' ' ' PRO . 4.0 mp -101.33 -65.27 1.34 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.846 -0.615 . . . . 0.0 110.108 -177.091 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -113.14 82.78 1.72 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.31 0.576 . . . . 0.0 109.935 174.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 60.82 -176.4 0.11 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 114.722 -1.126 . . . . 0.0 112.765 -177.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.954 ' HD3' ' H ' ' A' ' 133' ' ' LYS . 2.1 mppt? -61.91 -65.3 0.71 Allowed 'General case' 0 C--O 1.235 0.328 0 CA-C-O 122.037 0.922 . . . . 0.0 110.3 -175.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 5.3 p -170.1 48.58 0.03 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 113.893 -1.503 . . . . 0.0 107.267 -177.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -94.79 -29.44 14.75 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.653 -1.158 . . . . 0.0 110.15 -172.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.595 ' HB ' ' OD1' ' A' ' 47' ' ' ASP . 28.3 mm -68.33 -86.45 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 114.734 -1.121 . . . . 0.0 112.514 -174.066 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -76.16 41.31 0.23 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -174.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 16.5 m -111.18 57.83 0.62 Allowed 'General case' 0 C--N 1.318 -0.796 0 CA-C-O 122.036 0.922 . . . . 0.0 108.619 171.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 18.4 tp -91.36 -0.74 57.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.634 -1.167 . . . . 0.0 109.247 -179.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 29.5 t70 77.59 28.34 0.58 Allowed 'General case' 0 CA--C 1.514 -0.419 0 CA-C-O 122.597 1.189 . . . . 0.0 108.661 176.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 27.3 pt . . . . . 0 C--N 1.316 -0.864 0 CA-C-N 114.001 -1.454 . . . . 0.0 110.077 175.642 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.6 m . . . . . 0 N--CA 1.477 0.887 0 CA-C-O 120.739 0.304 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 95.8 mt -94.09 105.98 17.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.764 0.316 . . . . 0.0 110.579 -178.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -114.95 118.84 34.58 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -136.97 150.71 48.33 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.039 -177.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 66.0 t30 73.91 -13.72 0.73 Allowed 'General case' 0 N--CA 1.467 0.391 0 O-C-N 124.019 0.825 . . . . 0.0 111.922 174.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.425 ' HB2' ' O ' ' A' ' 22' ' ' THR . 6.3 p -82.78 51.57 1.93 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.18 0.514 . . . . 0.0 111.03 179.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -81.15 112.53 18.59 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.701 -177.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . 88.14 14.35 62.54 Favored Glycine 0 CA--C 1.507 -0.424 0 C-N-CA 120.692 -0.766 . . . . 0.0 111.245 -179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.425 ' O ' ' HB2' ' A' ' 19' ' ' SER . 3.2 t -153.39 92.08 1.56 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.328 0.585 . . . . 0.0 109.669 -179.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -69.98 80.9 0.35 Allowed Glycine 0 C--N 1.332 0.309 0 CA-C-N 115.654 -0.703 . . . . 0.0 112.489 -177.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.805 HG21 ' HG3' ' A' ' 28' ' ' ARG . 78.7 t -124.14 -71.88 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-O 120.552 0.215 . . . . 0.0 110.626 -177.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -176.13 -66.08 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.739 179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.476 HD22 ' H ' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -121.6 -10.91 8.74 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.361 -0.836 . . . . 0.0 110.713 172.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.61 ' O ' ' HA ' ' A' ' 101' ' ' PRO . . . 113.04 110.11 2.98 Favored Glycine 0 N--CA 1.449 -0.454 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.712 179.398 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.805 ' HG3' HG21 ' A' ' 24' ' ' VAL . 10.8 mtm180 -56.41 -52.01 66.24 Favored 'General case' 0 CA--C 1.521 -0.166 0 CA-C-O 121.036 0.446 . . . . 0.0 110.751 177.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.452 ' O ' ' HD3' ' A' ' 31' ' ' PRO . 26.1 p-10 -91.1 156.75 17.66 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.77 -0.65 . . . . 0.0 109.621 179.501 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.877 ' HB3' ' HB3' ' A' ' 100' ' ' LEU . 3.7 pm0 -88.78 118.16 69.03 Favored Pre-proline 0 C--N 1.322 -0.619 0 CA-C-O 121.787 0.804 . . . . 0.0 112.219 -170.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.664 ' HD2' ' HA2' ' A' ' 103' ' ' GLY . 5.2 Cg_exo -77.4 -164.38 0.26 Allowed 'Trans proline' 0 N--CA 1.458 -0.559 0 C-N-CA 123.493 2.795 . . . . 0.0 111.435 169.517 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.537 ' HG ' ' NE2' ' A' ' 86' ' ' HIS . 7.7 tt -40.82 120.71 1.35 Allowed 'General case' 0 N--CA 1.464 0.24 0 C-N-CA 123.093 0.557 . . . . 0.0 110.635 173.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.779 ' HB3' ' H ' ' A' ' 105' ' ' LEU . 0.0 OUTLIER -56.83 121.75 10.6 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-O 121.473 0.654 . . . . 0.0 111.655 -177.426 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -95.2 -33.92 12.43 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 115.576 -0.738 . . . . 0.0 109.395 177.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -86.14 170.1 12.49 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.516 174.269 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -110.53 162.37 20.83 Favored Pre-proline 0 C--N 1.318 -0.782 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.56 -179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.56 ' HB2' HG12 ' A' ' 120' ' ' VAL . 22.0 Cg_exo -59.98 123.26 12.83 Favored 'Trans proline' 0 N--CA 1.46 -0.483 0 C-N-CA 121.625 1.55 . . . . 0.0 110.839 178.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.463 ' O ' ' HB3' ' A' ' 39' ' ' TRP . 3.4 tmmm? -108.09 122.14 46.28 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.891 0.853 . . . . 0.0 112.207 -168.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' TRP . . . . . 0.999 ' HE1' HG22 ' A' ' 120' ' ' VAL . 2.5 p-90 171.08 24.27 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 112.795 -2.002 . . . . 0.0 107.882 177.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.573 ' HD2' ' N ' ' A' ' 41' ' ' SER . 1.2 tmmt? -141.13 152.88 45.09 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.425 -0.807 . . . . 0.0 110.298 -153.742 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . 0.573 ' N ' ' HD2' ' A' ' 40' ' ' LYS . 48.2 m -64.62 127.29 30.9 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.447 -177.219 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -61.72 -29.54 70.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.86 175.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TYR . . . . . . . . . . . . . 60.3 t80 -147.56 95.95 4.21 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.693 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . . . . . . . . . 7.1 Cg_exo -73.52 129.02 13.24 Favored 'Trans proline' 0 N--CA 1.46 -0.456 0 C-N-CA 122.667 2.244 . . . . 0.0 111.866 176.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' MET . . . . . 0.633 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . 88.6 mtp -94.27 -85.27 0.3 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.057 -179.193 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 72.0 p -114.85 -178.16 3.3 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.423 -178.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . 0.521 ' HB3' ' HG2' ' A' ' 131' ' ' GLU . 9.0 p-10 -69.22 -33.36 73.19 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.81 0.338 . . . . 0.0 110.336 -179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -63.71 -38.05 95.62 Favored Glycine 0 N--CA 1.45 -0.43 0 C-N-CA 121.012 -0.613 . . . . 0.0 111.619 176.556 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.633 ' HG3' ' HB2' ' A' ' 45' ' ' MET . 15.7 mm100 -70.94 -41.54 71.01 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.856 0.36 . . . . 0.0 110.181 176.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.434 ' HG ' ' H ' ' A' ' 130' ' ' ILE . 1.0 OUTLIER -57.74 -50.42 73.27 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.643 -0.708 . . . . 0.0 110.455 -179.043 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.5 ' HG2' ' O ' ' A' ' 47' ' ' ASP . 7.2 ptm180 -66.51 -42.41 87.34 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.7 t -65.61 -52.08 54.73 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.924 0.392 . . . . 0.0 110.286 -178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.45 ' HG3' ' CE2' ' A' ' 57' ' ' PHE . 3.4 tppt? -63.1 -35.28 79.75 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.918 -0.583 . . . . 0.0 110.431 -179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 25.1 ttm180 -56.81 -46.94 81.29 Favored 'General case' 0 N--CA 1.462 0.143 0 CA-C-N 116.343 -0.389 . . . . 0.0 110.902 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.48 -46.11 73.92 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.003 0.43 . . . . 0.0 110.86 -177.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -53.44 -49.57 67.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.799 175.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.45 ' CE2' ' HG3' ' A' ' 53' ' ' LYS . 19.0 m-85 -63.22 -43.91 96.76 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.1 176.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' TRP . . . . . 0.655 ' HZ3' ' HA ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -49.6 -36.06 22.89 Favored 'General case' 0 N--CA 1.469 0.516 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 178.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -70.16 -26.12 63.77 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 111.78 0.289 . . . . 0.0 111.78 179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 6.6 m -96.12 -24.31 16.35 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.757 0.789 . . . . 0.0 109.821 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.539 ' HB1' ' HD2' ' A' ' 62' ' ' PRO . . . -68.32 159.18 82.02 Favored Pre-proline 0 N--CA 1.449 -0.477 0 CA-C-N 115.001 -0.999 . . . . 0.0 110.405 178.52 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.539 ' HD2' ' HB1' ' A' ' 61' ' ' ALA . 21.4 Cg_endo -82.9 -9.52 10.79 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 122.99 2.46 . . . . 0.0 112.713 -173.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.655 ' HA ' ' HZ3' ' A' ' 58' ' ' TRP . . . 59.5 -141.75 0.63 Allowed 'General case' 0 N--CA 1.456 -0.13 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.894 -177.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -103.38 0.54 31.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.092 0.472 . . . . 0.0 109.869 179.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -68.56 161.24 28.35 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.603 -0.726 . . . . 0.0 111.937 -175.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 123.28 179.03 15.66 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.29 -0.868 . . . . 0.0 111.576 -178.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 67' ' ' ARG . 37.7 mtt180 -65.89 109.75 2.62 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 120.962 0.41 . . . . 0.0 110.266 177.068 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.748 ' HA ' ' HB2' ' A' ' 71' ' ' TRP . 72.9 mmtt -64.84 -23.41 67.23 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.681 -179.564 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.401 ' HG3' ' H ' ' A' ' 69' ' ' GLU . 22.6 mt-10 -52.51 -53.63 43.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.893 -1.049 . . . . 0.0 111.031 174.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.772 HG13 HD13 ' A' ' 98' ' ' ILE . 0.0 OUTLIER -82.84 -25.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.324 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.668 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' TRP . . . . . 0.748 ' HB2' ' HA ' ' A' ' 68' ' ' LYS . 5.9 m95 -52.41 -35.95 53.14 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.053 177.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -55.68 -39.35 70.86 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.729 -0.669 . . . . 0.0 111.426 178.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -80.35 -28.76 37.98 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 120.896 0.379 . . . . 0.0 110.382 -175.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.49 HD21 ' CD1' ' A' ' 70' ' ' ILE . 21.8 mt -64.65 -49.87 69.32 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.25 -179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.635 ' HG2' ' O ' ' A' ' 71' ' ' TRP . 10.7 ptpt -73.43 -26.68 61.05 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.093 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.488 ' O ' ' HB3' ' A' ' 79' ' ' HIS . . . -67.33 -41.11 85.77 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-O 120.895 0.379 . . . . 0.0 110.636 175.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ALA . . . . . 0.655 ' HB1' ' HB1' ' A' ' 89' ' ' ALA . . . -66.94 -50.93 60.82 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.206 176.121 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . 0.586 ' O ' ' HG3' ' A' ' 82' ' ' GLU . . . -51.29 -32.89 26.43 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 115.816 -0.629 . . . . 0.0 110.733 173.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.488 ' HB3' ' O ' ' A' ' 76' ' ' ALA . 65.5 t60 -62.56 -50.67 70.41 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-O 120.894 0.378 . . . . 0.0 110.468 178.558 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 85' ' ' ASP . . . -66.08 -52.06 52.31 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.559 177.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.466 ' CE1' ' HD2' ' A' ' 33' ' ' LYS . 10.4 t80 -55.68 -26.79 46.65 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.32 178.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.586 ' HG3' ' O ' ' A' ' 78' ' ' ALA . 26.0 mt-10 -57.22 -34.56 68.68 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 121.671 -0.643 . . . . 0.0 110.785 173.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 12.5 t -90.77 16.62 8.93 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.461 178.014 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 65.8 t30 70.68 8.52 6.6 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-N 115.213 -0.903 . . . . 0.0 110.397 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.58 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 11.0 t0 -76.07 93.37 3.3 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.784 -177.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' HIS . . . . . 0.641 ' O ' ' HG3' ' A' ' 90' ' ' GLN . 66.2 m80 -71.37 -50.79 28.61 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.881 -0.6 . . . . 0.0 110.777 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -58.61 -40.65 83.87 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.108 -0.496 . . . . 0.0 112.191 -171.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.535 ' O ' HG13 ' A' ' 92' ' ' ILE . 8.8 mt -59.01 -52.48 65.57 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.89 0.376 . . . . 0.0 110.812 176.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.891 ' HB1' HD21 ' A' ' 105' ' ' LEU . . . -65.59 -40.02 92.22 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.711 -0.677 . . . . 0.0 111.467 -175.173 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.641 ' HG3' ' O ' ' A' ' 86' ' ' HIS . 19.9 mt-30 -58.08 -46.59 85.2 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.528 -0.306 . . . . 0.0 110.468 176.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -73.15 -25.08 60.68 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.724 -175.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.535 HG13 ' O ' ' A' ' 88' ' ' LEU . 46.4 mt -69.91 -59.43 3.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-O 120.641 0.258 . . . . 0.0 110.628 177.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ILE . . . . . 0.534 ' CG2' HG22 ' A' ' 98' ' ' ILE . 10.6 mm -53.04 -59.48 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.301 176.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -63.93 -25.26 68.06 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.364 -177.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . -66.63 -10.97 56.11 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.622 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.624 ' HB3' HD12 ' A' ' 98' ' ' ILE . . . -112.41 15.89 20.09 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 122.548 -0.384 . . . . 0.0 111.574 -179.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 72.2 9.72 5.94 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 122.041 0.924 . . . . 0.0 108.948 -177.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.772 HD13 HG13 ' A' ' 70' ' ' ILE . 50.3 mt -96.25 138.03 22.63 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.137 0 CA-C-N 113.973 -1.467 . . . . 0.0 109.594 -176.208 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' THR . . . . . 0.633 ' HB ' ' O ' ' A' ' 28' ' ' ARG . 34.3 p -139.13 168.66 19.34 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 120.227 -0.589 . . . . 0.0 112.178 -170.496 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.92 HD12 ' H ' ' A' ' 104' ' ' ALA . 2.7 tm? -149.38 99.62 3.39 Favored Pre-proline 0 N--CA 1.452 -0.354 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.086 174.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' PRO . . . . . 0.61 ' HA ' ' O ' ' A' ' 27' ' ' GLY . 56.0 Cg_endo -66.68 -10.72 29.07 Favored 'Trans proline' 0 N--CA 1.475 0.383 0 C-N-CA 123.433 2.756 . . . . 0.0 113.29 -171.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' HIS . . . . . 0.679 ' H ' HD13 ' A' ' 100' ' ' LEU . 48.8 m170 -84.02 -9.85 58.33 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 116.473 -0.33 . . . . 0.0 110.702 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLY . . . . . 0.664 ' HA2' ' HD2' ' A' ' 31' ' ' PRO . . . 67.84 38.15 89.03 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.155 -0.545 . . . . 0.0 112.623 -176.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.92 ' H ' HD12 ' A' ' 100' ' ' LEU . . . -122.67 139.39 54.0 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.287 0.565 . . . . 0.0 111.391 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.891 HD21 ' HB1' ' A' ' 89' ' ' ALA . 0.5 OUTLIER -76.9 -22.08 53.93 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.043 -0.98 . . . . 0.0 108.412 176.625 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.578 HG22 HD13 ' A' ' 123' ' ' LEU . 59.1 p -91.84 18.11 8.19 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 114.951 -1.022 . . . . 0.0 111.606 -172.183 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.608 ' O ' ' HG ' ' A' ' 100' ' ' LEU . 51.7 mt-10 -150.62 149.14 29.49 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 171.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.445 ' SG ' HD22 ' A' ' 74' ' ' LEU . 80.6 m -150.55 144.09 25.09 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 120.798 0.332 . . . . 0.0 110.416 176.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . 0.642 ' CE1' ' HG3' ' A' ' 115' ' ' ARG . 18.0 m-30 -118.48 121.73 40.99 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.093 0.473 . . . . 0.0 109.835 177.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASP . . . . . 1.051 ' HB3' ' HB2' ' A' ' 114' ' ' ASN . 1.3 t70 -79.78 145.18 32.98 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 114.862 -1.063 . . . . 0.0 109.597 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -59.6 -24.47 63.82 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.518 -0.765 . . . . 0.0 112.967 -168.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 28.0 mt -76.82 -13.73 59.98 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.118 0.485 . . . . 0.0 110.495 -179.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 114.23 28.05 3.2 Favored Glycine 0 N--CA 1.445 -0.713 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.452 179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASN . . . . . 1.051 ' HB2' ' HB3' ' A' ' 110' ' ' ASP . 51.5 m-80 -94.1 143.01 26.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.794 0.297 . . . . 0.0 110.766 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.642 ' HG3' ' CE1' ' A' ' 109' ' ' TYR . 53.2 ttp180 -123.3 121.19 35.21 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 109.832 -0.433 . . . . 0.0 109.832 177.579 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -127.16 140.7 52.07 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.942 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.458 ' O ' ' HG3' ' A' ' 62' ' ' PRO . 25.8 mt-30 -123.11 146.36 47.79 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -175.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LEU . . . . . 0.706 HD12 ' HD2' ' A' ' 119' ' ' PRO . 15.8 tp -111.96 121.98 38.15 Favored Pre-proline 0 C--N 1.317 -0.819 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -167.227 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.706 ' HD2' HD12 ' A' ' 118' ' ' LEU . 14.5 Cg_exo -72.13 157.49 54.01 Favored 'Trans proline' 0 CA--C 1.534 0.522 0 C-N-CA 123.847 3.031 . . . . 0.0 113.372 177.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.999 HG22 ' HE1' ' A' ' 39' ' ' TRP . 9.3 m -69.62 -14.41 18.32 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.427 0 CA-C-N 115.295 -0.866 . . . . 0.0 112.385 -175.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' TYR . . . . . 0.586 ' HD1' ' HB2' ' A' ' 119' ' ' PRO . 4.5 p90 -56.46 -22.3 31.28 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 112.771 0.656 . . . . 0.0 112.771 -168.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 40.7 t -124.75 16.41 8.71 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.818 0.342 . . . . 0.0 110.919 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' LEU . . . . . 0.578 HD13 HG22 ' A' ' 106' ' ' THR . 72.7 mt -131.63 -54.34 1.01 Allowed 'General case' 0 C--N 1.328 -0.365 0 O-C-N 122.138 -0.351 . . . . 0.0 111.705 -177.433 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.528 ' C ' ' HD2' ' A' ' 126' ' ' PRO . . . -129.98 111.74 17.17 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-O 120.828 0.346 . . . . 0.0 110.583 -175.131 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' PRO . . . . . 0.44 ' N ' ' HD2' ' A' ' 126' ' ' PRO . 89.8 Cg_endo -87.54 -4.67 7.4 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.029 2.486 . . . . 0.0 117.787 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' PRO . . . . . 0.528 ' HD2' ' C ' ' A' ' 124' ' ' ALA . 30.6 Cg_endo -63.89 -26.31 67.14 Favored 'Trans proline' 0 C--N 1.371 1.734 0 CA-C-N 123.076 2.134 . . . . 0.0 112.499 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' ILE . . . . . 0.786 ' H ' HD13 ' A' ' 127' ' ' ILE . 0.2 OUTLIER -105.6 45.52 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 121.438 0.637 . . . . 0.0 110.107 179.269 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -79.4 -56.54 4.26 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.898 -172.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' MET . . . . . . . . . . . . . 16.5 tpt -152.84 86.3 1.25 Allowed 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 177.741 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' ILE . . . . . 0.434 ' H ' ' HG ' ' A' ' 50' ' ' LEU . 33.2 mm -71.28 146.39 11.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.629 -177.672 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' GLU . . . . . 0.521 ' HG2' ' HB3' ' A' ' 47' ' ' ASP . 19.2 mt-10 -139.34 -156.49 0.68 Allowed 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.287 -0.87 . . . . 0.0 111.086 -176.279 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' GLU . . . . . 0.536 ' HB2' HD11 ' A' ' 136' ' ' ILE . 3.8 mm-40 -65.58 -173.7 0.17 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.697 -0.683 . . . . 0.0 112.44 -178.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LYS . . . . . 0.485 ' HB3' ' NZ ' ' A' ' 133' ' ' LYS . 6.6 ttpm? -46.09 -72.96 0.05 OUTLIER 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 114.364 -1.289 . . . . 0.0 112.769 -176.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' SER . . . . . . . . . . . . . 7.7 t -175.25 25.98 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.089 0.947 . . . . 0.0 108.605 -179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -100.51 -13.54 18.61 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 114.532 -1.213 . . . . 0.0 110.591 -175.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' ILE . . . . . 0.536 HD11 ' HB2' ' A' ' 132' ' ' GLU . 32.8 mm -51.54 134.61 12.69 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.91 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.516 175.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' GLU . . . . . 0.515 ' O ' HD12 ' A' ' 139' ' ' LEU . 9.9 pt-20 37.34 77.32 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.688 0 O-C-N 124.271 0.982 . . . . 0.0 111.584 -170.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 5.0 m -54.36 107.64 0.3 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.595 -176.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 137' ' ' GLU . 7.8 mp -73.02 134.88 44.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.054 0.454 . . . . 0.0 111.15 179.093 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -95.43 -25.6 16.19 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 172.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' ILE . . . . . . . . . . . . . 3.7 pt . . . . . 0 C--O 1.249 1.077 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.685 177.91 . . . . . . . . 0 0 . 1 stop_ save_