data_1ld6_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 1ld6 _Structure_validation_residue.Date_analyzed 2016-10-06 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 ' 1' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.577 0.227 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.459 ' O ' ' HB2' ' A' ' 5' ' ' CYS . 37.9 Cg_exo -58.09 136.42 74.81 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.405 2.07 . . . . 0.0 112.368 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.56 -60.02 2.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.428 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 27.3 p90 -51.66 -29.83 19.45 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 2' ' ' PRO . 66.9 m -59.46 -21.03 59.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.012 0.434 . . . . 0.0 110.699 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.4 mt -81.86 -11.39 58.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.225 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.428 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 6.8 mt-10 -72.24 114.88 33.34 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.539 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.9 158.19 7.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 111.896 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.449 ' HG3' ' CZ ' ' A' ' 22' ' ' PHE . 95.0 Cg_endo -77.12 143.08 22.32 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.318 2.012 . . . . 0.0 112.371 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.532 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 27.8 p90 -87.94 130.63 34.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.912 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.24 94.0 6.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.265 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -118.61 -95.73 1.71 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.323 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -161.89 97.96 1.06 Allowed 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 120.849 0.357 . . . . 0.0 111.44 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.782 179.603 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.702 0.287 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.434 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -102.02 164.01 11.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.129 0.49 . . . . 0.0 111.237 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.459 ' CE1' ' HA ' ' A' ' 47' ' ' SER . 48.6 m-85 -136.84 156.69 48.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.965 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.539 ' HB2' ' OD1' ' A' ' 43' ' ' ASN . 8.3 p90 -144.42 159.9 41.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.56 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -86.74 145.15 26.76 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.692 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -114.26 87.95 2.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.648 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.23 -23.84 6.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.673 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.68 -0.96 57.8 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.43 -1.94 1.28 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 -3.29 4.28 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 121.04 -0.6 . . . . 0.0 114.515 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.76 171.93 7.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.088 0.444 . . . . 0.0 111.016 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 11.7 m -100.86 177.66 4.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.256 0.55 . . . . 0.0 111.267 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 2.7 tp60 -149.39 138.7 21.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.358 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.434 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 5.2 t -83.23 31.8 0.45 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.38 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.433 ' CE1' ' HA ' ' A' ' 39' ' ' ALA . 90.4 m-85 65.48 159.63 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.393 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -167.12 172.71 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.624 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.431 ' C ' ' H ' ' A' ' 37' ' ' ALA . 0.1 OUTLIER 43.75 -165.6 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.439 0.637 . . . . 0.0 110.7 -179.785 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.29 22.11 0.82 Allowed Glycine 0 C--N 1.311 -0.835 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.818 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 35' ' ' TYR . . . -65.61 130.92 44.99 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 117.402 0.601 . . . . 0.0 110.956 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.532 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 1.2 m -84.21 153.76 23.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.159 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.433 ' HA ' ' CE1' ' A' ' 33' ' ' PHE . . . -69.42 132.48 46.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.949 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.82 151.12 28.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.219 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -65.42 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.973 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.417 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 10.1 mmp_? -85.46 -42.25 14.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.45 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.539 ' OD1' ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.93 69.61 1.9 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.161 0.505 . . . . 0.0 110.408 -177.858 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.3 p-10 -156.44 105.71 2.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.261 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.486 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 83.3 m-85 -108.77 143.09 38.37 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.817 0.341 . . . . 0.0 110.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -63.39 -16.59 60.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.459 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -154.54 147.88 24.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.901 0.381 . . . . 0.0 111.164 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.432 ' HB1' ' CD2' ' A' ' 21' ' ' TYR . . . -59.44 -37.43 78.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.81 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -60.54 -38.69 85.3 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.486 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -64.63 -45.31 87.4 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.203 178.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.403 ' O ' ' N ' ' A' ' 55' ' ' CYS . 5.1 t -61.01 -54.82 40.2 Favored 'General case' 0 C--N 1.339 0.114 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.437 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 95.3 mt -56.39 -38.23 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.381 179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -60.55 -53.85 52.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.831 0.348 . . . . 0.0 111.013 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.9 m -79.31 -56.2 4.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.841 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.403 ' N ' ' O ' ' A' ' 51' ' ' CYS . 73.7 m -76.52 -41.46 46.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.437 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.226 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.121 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.0 ttm105 . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.61 0.243 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -63.39 131.03 30.35 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.125 1.883 . . . . 0.0 111.818 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -50.44 -51.62 45.11 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.43 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 6.4 p90 -51.39 -24.09 4.47 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.466 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 66.2 m -60.0 -19.96 55.26 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.134 0.493 . . . . 0.0 110.683 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.25 -11.54 57.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.43 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 59.0 mt-10 -72.0 119.84 76.75 Favored Pre-proline 0 N--CA 1.461 0.124 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.105 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -88.46 151.63 6.49 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 122.687 2.258 . . . . 0.0 112.033 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.42 ' HG3' ' CE2' ' A' ' 22' ' ' PHE . 73.8 Cg_endo -74.97 -172.14 1.17 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.316 2.011 . . . . 0.0 112.291 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.455 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 1.1 p90 -152.45 156.8 40.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -103.97 75.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.34 -164.59 40.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.535 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 77.72 6.89 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.64 0.257 . . . . 0.0 111.557 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.463 0.221 0 CA-C-O 120.953 0.406 . . . . 0.0 110.399 179.859 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mmm-85 -140.02 -177.03 4.81 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 111.965 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -130.47 175.47 8.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.016 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.429 ' CD1' ' O ' ' A' ' 31' ' ' GLN . 19.7 p90 -146.9 150.25 34.85 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.297 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.466 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 84.1 t80 -85.98 134.07 33.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.6 t-20 -104.69 92.28 4.21 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.79 -28.01 32.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.353 . . . . 0.0 111.291 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -1.14 47.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.94 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.48 -2.93 1.55 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.6 -4.35 4.08 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 114.532 0.573 . . . . 0.0 114.532 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -124.37 169.63 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.161 0.481 . . . . 0.0 111.418 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m -101.6 166.0 10.93 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.947 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.429 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -149.57 151.49 33.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.866 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -78.0 137.71 38.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.105 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 38' ' ' CYS . 84.0 m-85 -46.39 106.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.089 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.3 -176.11 2.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.912 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.494 ' C ' ' H ' ' A' ' 37' ' ' ALA . 21.7 p90 -43.72 139.42 2.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.315 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.34 -8.35 0.04 OUTLIER Glycine 0 N--CA 1.438 -1.199 0 N-CA-C 114.65 0.62 . . . . 0.0 114.65 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.494 ' H ' ' C ' ' A' ' 35' ' ' TYR . . . -71.7 105.19 3.62 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 117.597 0.698 . . . . 0.0 111.453 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.455 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -88.11 171.92 9.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.778 0.323 . . . . 0.0 111.036 179.517 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.44 141.26 50.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.82 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.99 174.63 6.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.062 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -62.9 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.607 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.5 mmm-85 -89.99 -34.49 15.97 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.62 79.11 2.0 Allowed 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.969 0.414 . . . . 0.0 110.972 -177.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -157.45 97.54 1.62 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.568 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.509 ' CG ' ' HA ' ' A' ' 51' ' ' CYS . 97.9 m-85 -105.08 140.4 38.31 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.3 -18.11 47.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.851 -178.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.79 151.2 21.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 0.0 111.04 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.54 -38.28 74.46 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -61.38 -38.31 86.54 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.49 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.46 -45.29 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.969 178.252 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 1.4 t -60.66 -55.38 33.91 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.927 0.394 . . . . 0.0 110.119 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.431 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 71.6 mt -53.3 -43.22 67.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.367 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -52.36 65.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.761 0.315 . . . . 0.0 111.207 -179.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.426 ' HB ' ' CE1' ' A' ' 45' ' ' PHE . 2.9 m -79.16 -57.32 3.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -82.79 -37.21 24.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.431 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.223 0 C-N-CA 120.437 -0.887 . . . . 0.0 112.744 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.615 0.245 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.408 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.9 Cg_exo -63.42 136.23 53.88 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.318 2.012 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -44.29 -61.71 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -51.05 -30.2 14.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 73.6 m -60.79 -20.24 61.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.106 0.479 . . . . 0.0 110.629 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.0 mt -80.25 -13.56 59.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.133 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -71.86 114.85 32.32 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.014 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 87.2 Cg_endo -85.0 152.08 11.06 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.46 2.107 . . . . 0.0 112.43 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 14.6 Cg_endo -90.34 -169.11 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.052 2.501 . . . . 0.0 111.671 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.489 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 39.9 p90 -152.33 133.24 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.884 0.373 . . . . 0.0 111.367 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -110.32 111.06 22.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.272 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -160.54 -109.88 0.26 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.49 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.16 78.32 6.83 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.0 m . . . . . 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.323 179.339 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.683 0.278 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.452 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 1.5 mtp180 -132.11 164.38 26.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.252 0.548 . . . . 0.0 110.869 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' TYR . 2.4 m-85 -143.68 177.95 8.14 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.706 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.43 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 19.1 p90 -149.5 157.33 43.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.031 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CG ' ' HB3' ' A' ' 55' ' ' CYS . 60.6 t80 -84.38 144.39 28.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.927 0.394 . . . . 0.0 111.305 -179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -116.72 89.6 3.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.125 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.15 -24.49 10.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.432 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -3.87 58.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.931 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.27 -2.05 1.86 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.38 -3.26 8.32 Favored Glycine 0 N--CA 1.446 -0.664 0 N-CA-C 114.772 0.669 . . . . 0.0 114.772 178.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.22 175.74 7.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.342 0.571 . . . . 0.0 111.436 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.5 m -100.79 173.05 6.69 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.265 0.555 . . . . 0.0 111.605 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.13 151.61 34.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.996 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 t -77.42 149.06 35.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.88 0.371 . . . . 0.0 110.726 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.85 111.77 3.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.998 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.29 158.21 36.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.875 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -64.57 65.05 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.205 0.526 . . . . 0.0 111.355 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 171.68 -33.85 0.14 Allowed Glycine 0 N--CA 1.429 -1.813 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.574 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -65.77 124.15 21.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.489 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -81.93 153.81 26.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.565 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.32 118.38 11.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.244 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.64 168.02 19.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.889 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.407 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 2.7 tttp -60.97 -77.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.1 mmm-85 -92.86 -29.35 15.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.935 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.33 72.22 2.36 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.031 0.443 . . . . 0.0 111.03 -177.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 41' ' ' LYS . 5.0 p30 -159.5 101.71 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.496 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.463 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.6 m-85 -107.24 136.57 46.83 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.701 0.286 . . . . 0.0 110.473 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -64.36 -12.33 41.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.494 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -154.44 147.36 24.49 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.905 0.384 . . . . 0.0 111.387 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.93 81.61 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.624 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 13.6 mt-10 -58.51 -38.44 77.72 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.463 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.12 -46.48 74.03 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.412 ' O ' ' N ' ' A' ' 55' ' ' CYS . 7.7 t -63.72 -54.07 41.17 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.5 0.667 . . . . 0.0 109.591 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.413 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 19.9 mt -53.58 -42.75 67.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.641 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -61.51 -54.96 36.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 0.0 111.577 -179.537 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 m -77.76 -51.0 11.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.453 ' HB3' ' CG ' ' A' ' 23' ' ' TYR . 99.1 m -87.59 -37.11 17.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.413 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.273 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.014 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.587 0.232 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.406 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 14.8 Cg_exo -65.02 131.96 30.51 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.267 1.978 . . . . 0.0 111.959 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.13 -55.82 9.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -51.03 -27.47 7.98 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.406 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 78.1 m -59.59 -23.82 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.161 0.505 . . . . 0.0 110.378 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mt -80.98 -13.53 58.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.622 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -73.12 117.07 56.97 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.756 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.12 160.46 45.44 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.14 1.893 . . . . 0.0 111.874 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.426 ' HD3' ' CD2' ' A' ' 22' ' ' PHE . 5.9 Cg_exo -41.46 170.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.936 2.424 . . . . 0.0 112.996 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD1' ' N ' ' A' ' 11' ' ' ALA . 37.3 t80 -79.67 166.59 21.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.73 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.499 ' N ' ' CD1' ' A' ' 10' ' ' TYR . . . -137.9 91.61 2.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.198 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.24 -164.06 10.28 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.67 36.0 0.69 Allowed 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.764 0.316 . . . . 0.0 110.718 179.973 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.877 0.37 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.2 mtm-85 -99.89 179.64 4.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.279 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.47 ' CE1' ' HA ' ' A' ' 47' ' ' SER . 14.8 m-85 -135.63 168.5 19.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.466 ' CZ ' ' HB3' ' A' ' 31' ' ' GLN . 52.0 p90 -145.32 156.79 44.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.353 178.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -85.94 140.54 30.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.922 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -107.53 89.29 2.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.009 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.84 -25.16 10.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.792 0.33 . . . . 0.0 111.309 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -92.49 1.84 57.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.094 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.69 -1.59 1.63 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 64.35 -4.45 1.37 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.89 172.45 8.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 117.236 0.518 . . . . 0.0 111.096 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.2 m -103.29 170.63 7.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.323 0.582 . . . . 0.0 111.194 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -151.08 143.49 24.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.186 179.74 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.429 ' N ' ' HG3' ' A' ' 31' ' ' GLN . 1.7 t -75.82 130.65 38.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.728 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 22' ' ' PHE . 64.9 m-85 -55.09 161.3 1.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.071 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.07 -159.28 0.38 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 112.029 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -36.91 140.86 0.14 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.143 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 43.99 38.44 4.66 Favored Glycine 0 N--CA 1.434 -1.444 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.229 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.63 91.61 0.76 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.102 0.477 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.412 ' N ' ' HB3' ' A' ' 10' ' ' TYR . 36.8 m -88.48 174.62 8.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.158 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.09 127.88 33.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.156 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.37 144.68 32.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.943 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -33.78 76.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.669 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -82.76 0.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.89 103.73 14.21 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.308 0.575 . . . . 0.0 111.596 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -159.15 106.99 1.81 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.883 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.48 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 88.7 m-85 -105.04 136.91 43.65 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.853 0.359 . . . . 0.0 110.866 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.63 -15.1 50.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.576 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.47 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -151.17 146.65 26.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.008 0.433 . . . . 0.0 111.235 179.931 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.434 ' HB1' ' CD2' ' A' ' 21' ' ' TYR . . . -59.49 -38.98 82.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.055 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -60.05 -38.48 82.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.48 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.93 -43.88 86.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.102 178.492 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.429 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -62.25 -55.91 23.75 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.511 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.3 mt -55.04 -41.27 71.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.359 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -59.38 -51.34 70.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.828 0.347 . . . . 0.0 110.978 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.442 ' HB ' ' CZ ' ' A' ' 45' ' ' PHE . 7.0 m -80.02 -58.71 3.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.725 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 17.4 m -73.88 -43.99 56.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.736 -179.356 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . 0.425 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 9.7 ptp85 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.493 0.187 . . . . 0.0 111.259 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 13.7 Cg_exo -67.77 132.45 26.78 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.437 2.091 . . . . 0.0 112.155 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -58.16 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.5 ' HB2' ' HB2' ' A' ' 42' ' ' ARG . 13.8 p90 -51.3 -26.61 7.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.448 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 78.5 m -60.08 -19.93 55.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.084 0.468 . . . . 0.0 110.409 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.9 mt -81.75 -7.09 59.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.842 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 31.7 mm-40 -71.19 118.83 69.39 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.242 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 10.0 Cg_exo -70.79 150.43 61.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.5 2.134 . . . . 0.0 112.112 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.4 Cg_endo -80.26 -176.97 3.47 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.744 2.296 . . . . 0.0 111.919 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -153.99 161.46 41.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.74 108.4 7.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.11 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 172.74 143.94 4.38 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.454 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.63 35.06 1.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 111.337 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.929 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.655 0.264 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -146.13 168.0 22.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.595 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -137.23 173.15 11.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.914 0.388 . . . . 0.0 111.117 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.483 ' CE1' ' HB2' ' A' ' 31' ' ' GLN . 25.7 p90 -147.29 155.13 41.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.448 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -86.57 140.0 30.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -115.48 90.28 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.18 -29.67 33.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -79.05 -2.02 38.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.473 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.65 -1.84 2.01 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.77 -8.6 1.68 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 121.053 -0.594 . . . . 0.0 114.542 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.69 176.86 6.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 117.34 0.57 . . . . 0.0 111.253 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.1 m -97.34 171.43 8.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.335 0.588 . . . . 0.0 111.315 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.483 ' HB2' ' CE1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -146.54 142.46 28.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.601 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 t -75.43 137.9 41.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 110.624 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.501 ' HB3' ' HB1' ' A' ' 37' ' ' ALA . 47.3 m-85 -53.9 124.1 14.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.514 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 37' ' ' ALA . . . -74.97 -171.45 1.34 Allowed 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.067 -179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -51.36 142.6 13.08 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.878 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 44.8 17.13 0.08 OUTLIER Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 115.556 -0.747 . . . . 0.0 114.92 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 33' ' ' PHE . . . -69.74 -178.97 1.63 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 117.746 0.773 . . . . 0.0 110.321 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.433 ' O ' ' CE1' ' A' ' 33' ' ' PHE . 0.9 OUTLIER -155.17 152.07 28.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.124 0.487 . . . . 0.0 111.41 179.713 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.34 139.84 50.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.236 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -92.99 -174.32 3.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.088 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -80.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.691 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.5 ' HB2' ' HB2' ' A' ' 4' ' ' PHE . 8.4 mmt-85 -87.91 -33.77 18.38 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.21 71.84 2.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.12 0.486 . . . . 0.0 110.447 -178.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -156.02 92.99 1.4 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.668 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.498 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.3 m-85 -107.01 131.02 54.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -12.03 18.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.795 -179.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.73 148.95 24.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.921 0.391 . . . . 0.0 111.276 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.11 74.88 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -38.57 84.93 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.498 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -66.57 -46.41 76.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.286 178.594 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.448 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 2.4 t -60.58 -55.58 31.65 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-O 121.028 0.442 . . . . 0.0 110.144 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.407 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 47.7 mt -53.23 -42.54 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.553 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -59.7 -51.78 68.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.829 0.347 . . . . 0.0 111.147 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.0 m -78.66 -58.57 3.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.088 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 23.2 m -76.72 -41.15 46.25 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.407 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.24 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.485 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.616 0.246 . . . . 0.0 111.15 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.98 138.81 81.16 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.287 1.991 . . . . 0.0 112.091 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -61.96 1.41 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.403 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.457 ' HB2' ' CB ' ' A' ' 42' ' ' ARG . 20.4 p90 -51.99 -29.83 22.46 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.6 m -61.65 -18.15 58.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.088 0.47 . . . . 0.0 110.743 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.44 -12.11 59.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.968 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -72.42 114.39 29.32 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.964 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -82.45 149.57 14.83 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.429 2.086 . . . . 0.0 112.192 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.54 ' HG3' ' CD2' ' A' ' 22' ' ' PHE . 72.9 Cg_endo -94.17 144.78 1.81 Allowed 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.034 2.489 . . . . 0.0 112.556 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -87.84 142.37 27.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.666 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.36 108.36 14.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.145 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.61 143.3 6.11 Favored Glycine 0 C--N 1.33 0.203 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.554 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.91 49.26 4.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 0.0 111.111 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.7 t . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.126 -179.739 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.35 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.433 ' HB2' ' CD2' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -142.96 179.07 7.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.95 0.405 . . . . 0.0 110.918 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.425 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 46.2 m-85 -128.97 155.15 45.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.987 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.54 ' CD2' ' HG3' ' A' ' 9' ' ' PRO . 18.7 p90 -145.7 152.66 39.95 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.317 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -84.73 139.41 32.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' A' ' 29' ' ' LEU . 35.7 t-20 -112.4 88.06 2.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.345 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.71 -25.47 18.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.227 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -79.75 -4.77 53.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.616 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.3 1.1 1.76 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.73 -6.35 2.79 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 114.826 0.69 . . . . 0.0 114.826 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.422 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 2.3 mp -122.33 174.22 7.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.395 0.597 . . . . 0.0 111.341 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 22' ' ' PHE . 1.9 m -102.81 168.02 9.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.076 0.465 . . . . 0.0 110.936 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 23.5 mt-30 -148.39 156.87 43.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.609 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -79.75 147.8 31.73 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.864 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.457 ' HB3' ' HB1' ' A' ' 37' ' ' ALA . 42.0 m-85 -65.49 117.01 7.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.016 0.436 . . . . 0.0 111.373 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.71 -171.93 1.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.055 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -44.42 134.08 5.31 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.782 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 39.01 26.02 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 114.842 0.697 . . . . 0.0 114.842 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.457 ' HB1' ' HB3' ' A' ' 33' ' ' PHE . . . -69.36 168.39 14.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 117.207 0.503 . . . . 0.0 110.466 179.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 21.1 m -155.64 145.63 21.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 111.911 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.09 174.84 4.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 41' ' ' LYS . . . -124.08 34.01 5.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.894 0.378 . . . . 0.0 111.387 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.486 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER 91.19 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.487 179.149 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.457 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER -88.03 -40.22 14.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.82 -178.867 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.26 72.4 2.32 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.129 0.49 . . . . 0.0 110.521 -177.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -156.0 93.51 1.45 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.821 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.573 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 99.5 m-85 -105.54 130.2 53.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -63.02 -12.98 29.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.293 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -150.35 145.47 26.14 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.951 0.405 . . . . 0.0 111.391 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.425 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -60.26 -34.58 73.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.596 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.13 -39.2 85.45 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.573 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -65.13 -47.61 76.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.438 178.661 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.43 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 3.0 t -60.81 -52.95 62.89 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.366 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.4 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 95.5 mt -56.31 -45.12 80.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.485 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.38 91.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.77 0.319 . . . . 0.0 111.097 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.4 m -81.05 -62.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -85.49 -29.44 24.27 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.4 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.517 0.179 0 C-N-CA 120.164 -1.017 . . . . 0.0 112.386 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.373 0.13 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.409 ' HG2' ' HA ' ' A' ' 55' ' ' CYS . 20.8 Cg_exo -60.91 136.53 66.47 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.991 1.794 . . . . 0.0 111.717 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.11 -56.65 8.45 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -52.05 -23.6 5.48 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.625 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 70.7 m -62.05 -17.48 57.54 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.978 0.418 . . . . 0.0 110.647 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.1 mt -82.93 -14.53 53.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.231 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.63 119.23 74.02 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.195 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -85.98 156.73 10.01 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.656 2.237 . . . . 0.0 112.258 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -88.63 -177.84 1.82 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.695 2.264 . . . . 0.0 112.029 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 27.4 p90 -152.94 152.07 31.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.914 0.388 . . . . 0.0 111.115 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -125.48 124.07 40.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.337 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -178.45 89.08 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.189 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.49 94.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.852 0.358 . . . . 0.0 111.186 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.2 m . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.591 179.83 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.615 0.245 . . . . 0.0 111.526 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -137.47 166.42 23.91 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.434 178.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -136.07 165.48 25.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 111.755 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.488 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 12.5 p90 -144.53 153.08 41.46 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.56 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.625 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 82.9 t80 -84.43 139.71 32.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.158 0.504 . . . . 0.0 111.707 -178.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -115.62 90.15 3.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.024 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.424 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . . . -52.74 -28.53 22.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.8 0.333 . . . . 0.0 111.356 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -1.84 37.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.611 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.69 -3.07 1.5 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.98 -3.73 3.78 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.57 172.8 9.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.231 0.516 . . . . 0.0 111.39 -179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 2.0 m -100.41 170.11 8.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.074 0.464 . . . . 0.0 111.485 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -147.99 151.51 35.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.444 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.52 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 1.5 t -74.22 147.18 42.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.429 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -74.72 131.15 40.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.559 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.452 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.52 157.68 37.15 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.64 64.13 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.205 0.526 . . . . 0.0 110.822 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.452 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 168.77 -27.95 0.14 Allowed Glycine 0 N--CA 1.429 -1.805 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.362 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -63.35 129.99 42.6 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.932 0.396 . . . . 0.0 111.656 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 13.6 m -83.5 149.62 26.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.976 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.65 164.01 24.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.781 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -112.72 168.15 9.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.113 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -63.78 -75.35 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.593 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 -86.26 -31.9 21.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.484 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.433 ' O ' ' HB3' ' A' ' 44' ' ' ASN . 0.5 OUTLIER -73.79 -177.01 2.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.13 0.49 . . . . 0.0 109.955 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . 0.433 ' HB3' ' O ' ' A' ' 43' ' ' ASN . 56.5 t-20 74.0 115.65 0.06 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.62 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.423 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 64.2 m-85 -119.41 144.48 46.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.756 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -16.3 59.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.621 0.248 . . . . 0.0 111.434 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.85 146.21 25.51 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 111.32 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.77 81.03 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.092 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 2.0 tt0 -58.68 -39.86 81.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.423 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.56 -43.22 90.52 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.398 178.473 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.404 ' O ' ' N ' ' A' ' 55' ' ' CYS . 3.6 t -62.22 -58.19 8.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.16 0.505 . . . . 0.0 109.867 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.76 -44.97 70.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.846 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -59.36 -50.39 74.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.735 0.303 . . . . 0.0 111.206 -179.376 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -78.29 -61.25 2.07 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.409 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.8 OUTLIER -74.54 -41.37 60.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.218 0 C-N-CA 120.396 -0.907 . . . . 0.0 112.445 -179.658 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.556 0.217 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -52.97 132.77 48.98 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.055 1.837 . . . . 0.0 111.768 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -47.74 -51.92 20.42 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.405 ' CB ' ' HG3' ' A' ' 42' ' ' ARG . 2.8 p90 -52.23 -22.32 4.27 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.837 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.526 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.6 m -57.78 -20.29 34.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.167 0.508 . . . . 0.0 110.428 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.5 mt -82.21 -17.55 45.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.145 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 28.7 tp10 -75.45 111.43 14.09 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.454 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 36.9 Cg_endo -94.18 158.71 2.12 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 122.955 2.436 . . . . 0.0 112.292 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.94 -162.74 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.627 2.218 . . . . 0.0 112.095 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 18.6 p90 -150.21 144.92 25.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -110.55 115.14 29.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.848 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.37 138.62 3.05 Favored Glycine 0 C--N 1.328 0.111 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.211 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.38 45.4 8.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.046 0.451 . . . . 0.0 110.392 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.709 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.041 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.779 0.323 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.72 -177.79 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.22 0.533 . . . . 0.0 111.068 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -131.97 166.87 20.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.972 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -143.27 152.57 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.468 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.526 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 78.4 t80 -86.74 143.46 27.54 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.994 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . 0.402 ' HB3' ' HB3' ' A' ' 27' ' ' ALA . 51.9 t-20 -115.01 102.07 9.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.621 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.8 -27.0 59.2 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.31 -13.63 43.08 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 24' ' ' ASN . . . -115.04 -14.03 11.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.62 0.248 . . . . 0.0 111.664 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.68 -6.44 25.1 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 121.066 -0.587 . . . . 0.0 113.721 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 mp -127.69 176.61 7.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 0.0 110.796 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 m -101.61 168.17 9.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.256 0.551 . . . . 0.0 111.204 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -152.17 145.13 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.311 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.52 145.84 32.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.559 ' CE2' ' HA ' ' A' ' 39' ' ' ALA . 78.7 m-85 -58.61 134.47 56.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.446 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -164.68 171.89 13.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.793 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.1 t80 54.71 62.54 2.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.345 0.593 . . . . 0.0 110.394 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.709 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . 52.4 5.82 0.23 Allowed Glycine 0 N--CA 1.436 -1.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 114.407 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.81 126.12 26.96 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.076 0.938 . . . . 0.0 111.122 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -85.49 174.51 9.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.511 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.559 ' HA ' ' CE2' ' A' ' 33' ' ' PHE . . . -72.3 129.49 38.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.597 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.0 165.45 24.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.435 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -62.5 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.196 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.405 ' HG3' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -93.77 -24.72 17.69 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.13 79.3 2.27 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.95 0.405 . . . . 0.0 110.377 -178.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -155.52 105.48 2.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.514 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.479 ' CD2' ' HB2' ' A' ' 51' ' ' CYS . 86.8 m-85 -103.47 140.53 37.37 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.02 -15.3 30.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.783 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -165.85 154.33 11.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.896 0.379 . . . . 0.0 111.08 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.16 -38.08 75.93 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -60.32 -36.71 78.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -49.11 65.63 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.562 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.479 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 19.0 t -62.27 -55.63 26.45 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.891 0.377 . . . . 0.0 110.558 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . 0.497 ' HA ' ' HA3' ' A' ' 56' ' ' GLY . 79.5 mt -51.77 -52.59 47.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.85 -35.28 70.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.816 0.341 . . . . 0.0 110.77 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -80.07 -70.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.798 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.1 t -96.89 -23.07 16.52 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . 0.497 ' HA3' ' HA ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.926 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.415 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 16.6 Cg_exo -61.91 135.16 53.95 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.021 1.814 . . . . 0.0 111.888 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.19 -58.46 4.5 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . 0.477 ' HB3' ' HB3' ' A' ' 42' ' ' ARG . 8.2 p90 -49.93 -25.07 2.91 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.631 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.1 m -60.88 -26.18 67.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.123 0.487 . . . . 0.0 110.523 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 mt -83.63 -13.22 54.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.92 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.49 114.89 33.93 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.413 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -93.79 153.71 2.3 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.01 2.474 . . . . 0.0 112.089 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -78.13 147.26 23.39 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.398 2.065 . . . . 0.0 112.255 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.526 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 10.4 p90 -84.69 130.01 34.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -97.86 88.06 4.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 154.01 152.71 6.16 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.572 -0.823 . . . . 0.0 112.498 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 58.96 37.48 24.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.914 0.388 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.46 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 48.0 t . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.383 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.117 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.436 ' HB2' ' CD1' ' A' ' 33' ' ' PHE . 6.6 mtp85 -142.38 158.42 43.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 111.038 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.407 ' N ' ' CD1' ' A' ' 21' ' ' TYR . 3.1 m-85 -140.91 172.33 12.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.211 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 23.9 p90 -150.6 156.28 41.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.113 178.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.631 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -83.42 138.27 33.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.072 0.463 . . . . 0.0 110.965 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -105.4 91.39 3.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.319 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.57 -22.81 9.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.61 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.19 -1.6 57.68 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.59 -3.6 1.87 Allowed 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.404 ' HA2' ' OH ' ' A' ' 23' ' ' TYR . . . 70.44 -7.73 4.65 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 114.882 0.713 . . . . 0.0 114.882 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.1 mp -123.52 171.37 9.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.488 0.644 . . . . 0.0 111.674 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 1.4 m -101.68 164.27 11.83 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-O 121.386 0.612 . . . . 0.0 111.196 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -149.72 160.92 43.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.97 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 t -75.11 156.56 35.89 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.646 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.436 ' CD1' ' HB2' ' A' ' 20' ' ' ARG . 76.5 m-85 -72.89 98.68 2.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.255 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.531 ' O ' ' HB1' ' A' ' 37' ' ' ALA . . . -77.08 164.0 26.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.708 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.477 ' C ' ' H ' ' A' ' 37' ' ' ALA . 19.9 p90 41.56 -169.9 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.538 0.685 . . . . 0.0 111.299 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.46 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . -65.06 28.38 0.11 Allowed Glycine 0 C--N 1.311 -0.819 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.12 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.531 ' HB1' ' O ' ' A' ' 34' ' ' ALA . . . -67.15 128.3 35.87 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 118.449 1.124 . . . . 0.0 110.83 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.526 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 0.3 OUTLIER -84.17 165.01 18.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.056 0.455 . . . . 0.0 111.468 -179.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.98 136.72 46.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.412 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.37 152.93 44.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.865 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.28 -65.45 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.477 ' HB3' ' HB3' ' A' ' 4' ' ' PHE . 5.3 mtp180 -88.8 -54.05 4.33 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . 0.472 ' O ' ' ND2' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -84.6 96.94 9.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.571 0.7 . . . . 0.0 111.049 -178.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -156.81 95.49 1.53 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.668 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.502 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 85.0 m-85 -103.76 128.6 51.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.78 0.324 . . . . 0.0 110.911 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mttt -63.43 -13.49 40.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.923 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.32 142.41 33.84 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.017 0.437 . . . . 0.0 111.127 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.402 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -61.98 -38.17 87.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.336 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -58.99 -38.62 79.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.502 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -65.65 -44.05 87.54 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.201 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 55' ' ' CYS . 2.0 t -61.43 -55.34 32.48 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 88.7 mt -53.26 -42.93 66.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.293 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.51 79.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.864 0.364 . . . . 0.0 110.515 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.483 ' HB ' ' CZ ' ' A' ' 45' ' ' PHE . 8.0 m -80.13 -62.89 1.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.835 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.451 ' N ' ' O ' ' A' ' 51' ' ' CYS . 1.5 m -72.12 -44.69 62.78 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.235 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.681 -179.33 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.664 0.269 . . . . 0.0 111.247 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HG2' ' HA ' ' A' ' 55' ' ' CYS . 25.5 Cg_exo -58.14 152.09 54.63 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.239 1.959 . . . . 0.0 112.041 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -49.03 -61.31 2.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.673 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -55.12 -22.98 18.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.71 0.291 . . . . 0.0 111.245 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' CYS . . . . . 0.453 ' SG ' ' CD2' ' A' ' 23' ' ' TYR . 0.1 OUTLIER -60.46 -20.05 58.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.149 0.5 . . . . 0.0 109.964 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 16.5 mt -82.13 -17.06 47.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.409 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.35 114.21 27.66 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.007 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -85.37 156.71 10.88 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.572 2.182 . . . . 0.0 112.248 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PRO . . . . . 0.524 ' HG3' ' CD1' ' A' ' 22' ' ' PHE . 62.7 Cg_endo -85.87 176.15 5.49 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.636 2.224 . . . . 0.0 111.408 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . 0.44 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 1.1 p90 -155.74 149.73 25.45 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 111.771 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -117.62 107.79 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.46 -115.32 0.95 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.256 -0.973 . . . . 0.0 113.719 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . 0.411 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -75.55 77.75 2.57 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -178.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 13' ' ' ALA . 88.0 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.031 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.549 0.214 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -142.85 167.87 21.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.463 0.649 . . . . 0.0 111.216 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.401 ' CZ ' HG22 ' A' ' 32' ' ' THR . 61.6 m-85 -139.65 167.14 22.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.156 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PHE . . . . . 0.524 ' CD1' ' HG3' ' A' ' 9' ' ' PRO . 13.6 p90 -149.14 146.65 27.78 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.477 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CD2' ' SG ' ' A' ' 5' ' ' CYS . 83.5 t80 -83.93 132.07 34.8 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.922 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -102.23 98.1 8.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.502 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.409 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . . . -53.57 -33.12 53.63 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.385 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -83.23 3.35 31.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.953 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.53 -4.76 1.81 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.28 -6.62 2.22 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.886 0.715 . . . . 0.0 114.886 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.45 171.55 11.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.524 0.662 . . . . 0.0 111.225 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 1.6 m -96.35 168.39 10.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.114 0.483 . . . . 0.0 111.197 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 4.0 tt0 -147.62 152.71 38.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.737 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' THR . . . . . 0.401 HG22 ' CZ ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -76.62 134.46 39.32 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.821 179.078 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -61.01 166.63 3.39 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -168.52 -152.32 0.11 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.801 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.463 ' C ' ' H ' ' A' ' 37' ' ' ALA . 12.9 t80 -39.51 121.69 1.24 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . 0.42 ' O ' ' HA ' ' A' ' 11' ' ' ALA . . . 54.17 -2.92 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.167 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -67.44 106.82 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.967 0.883 . . . . 0.0 110.881 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' CYS . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 70.8 m -82.82 145.23 29.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.45 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 138.69 49.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.226 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -87.84 164.4 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.794 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -71.73 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.651 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -86.12 -38.74 17.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.068 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.62 70.04 2.4 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 121.229 0.538 . . . . 0.0 110.306 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -155.77 92.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.165 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.548 ' CG ' ' HA ' ' A' ' 51' ' ' CYS . 81.2 m-85 -106.29 134.47 49.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 110.662 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -13.75 25.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.021 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.66 150.84 26.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 0.0 111.095 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.37 -38.98 78.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -37.88 81.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . 0.476 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.22 -42.98 83.14 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.288 178.597 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.548 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 5.3 t -63.83 -59.76 4.13 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 121.159 0.504 . . . . 0.0 109.815 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -52.64 -42.28 64.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.436 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -59.16 -51.69 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.825 0.345 . . . . 0.0 111.181 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.453 ' HB ' ' CE1' ' A' ' 45' ' ' PHE . 2.0 m -79.96 -59.92 2.54 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.467 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' CYS . . . . . 0.454 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -69.63 -47.77 62.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.866 -178.846 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.268 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.582 -179.36 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.577 0.227 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.459 ' O ' ' HB2' ' A' ' 5' ' ' CYS . 37.9 Cg_exo -58.09 136.42 74.81 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.405 2.07 . . . . 0.0 112.368 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.56 -60.02 2.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.428 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 27.3 p90 -51.66 -29.83 19.45 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.459 ' HB2' ' O ' ' A' ' 2' ' ' PRO . 66.9 m -59.46 -21.03 59.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.012 0.434 . . . . 0.0 110.699 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.4 mt -81.86 -11.39 58.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.225 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.428 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 6.8 mt-10 -72.24 114.88 33.34 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.539 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.9 158.19 7.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 111.896 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.449 ' HG3' ' CZ ' ' A' ' 22' ' ' PHE . 95.0 Cg_endo -77.12 143.08 22.32 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.318 2.012 . . . . 0.0 112.371 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.532 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 27.8 p90 -87.94 130.63 34.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.912 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.24 94.0 6.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.265 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -118.61 -95.73 1.71 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.323 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -161.89 97.96 1.06 Allowed 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 120.849 0.357 . . . . 0.0 111.44 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 p -165.37 130.14 2.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.782 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -80.74 127.45 32.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.585 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -166.44 147.43 6.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.014 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -161.54 44.34 0.16 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.18 0.514 . . . . 0.0 111.062 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.81 161.83 30.36 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.873 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.48 45.26 0.66 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.395 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.434 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -102.02 164.01 11.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.129 0.49 . . . . 0.0 111.237 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.459 ' CE1' ' HA ' ' A' ' 47' ' ' SER . 48.6 m-85 -136.84 156.69 48.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.965 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.539 ' HB2' ' OD1' ' A' ' 43' ' ' ASN . 8.3 p90 -144.42 159.9 41.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.56 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -86.74 145.15 26.76 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.692 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -114.26 87.95 2.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.648 178.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.23 -23.84 6.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.673 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.68 -0.96 57.8 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.43 -1.94 1.28 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 -3.29 4.28 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 121.04 -0.6 . . . . 0.0 114.515 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -118.76 171.93 7.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.088 0.444 . . . . 0.0 111.016 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.457 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 11.7 m -100.86 177.66 4.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.256 0.55 . . . . 0.0 111.267 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.459 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 2.7 tp60 -149.39 138.7 21.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.358 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.434 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 5.2 t -83.23 31.8 0.45 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.38 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.433 ' CE1' ' HA ' ' A' ' 39' ' ' ALA . 90.4 m-85 65.48 159.63 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.393 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -167.12 172.71 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.624 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.431 ' C ' ' H ' ' A' ' 37' ' ' ALA . 0.1 OUTLIER 43.75 -165.6 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.439 0.637 . . . . 0.0 110.7 -179.785 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.29 22.11 0.82 Allowed Glycine 0 C--N 1.311 -0.835 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.818 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.431 ' H ' ' C ' ' A' ' 35' ' ' TYR . . . -65.61 130.92 44.99 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 117.402 0.601 . . . . 0.0 110.956 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.532 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 1.2 m -84.21 153.76 23.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.159 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.433 ' HA ' ' CE1' ' A' ' 33' ' ' PHE . . . -69.42 132.48 46.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.949 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.82 151.12 28.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.219 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -65.42 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.973 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.417 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 10.1 mmp_? -85.46 -42.25 14.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.45 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.539 ' OD1' ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.93 69.61 1.9 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.161 0.505 . . . . 0.0 110.408 -177.858 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.3 p-10 -156.44 105.71 2.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.261 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.486 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 83.3 m-85 -108.77 143.09 38.37 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.817 0.341 . . . . 0.0 110.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -63.39 -16.59 60.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.459 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -154.54 147.88 24.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.901 0.381 . . . . 0.0 111.164 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.432 ' HB1' ' CD2' ' A' ' 21' ' ' TYR . . . -59.44 -37.43 78.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.81 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -60.54 -38.69 85.3 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.486 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -64.63 -45.31 87.4 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.203 178.434 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.403 ' O ' ' N ' ' A' ' 55' ' ' CYS . 5.1 t -61.01 -54.82 40.2 Favored 'General case' 0 C--N 1.339 0.114 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.437 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 95.3 mt -56.39 -38.23 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.381 179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -60.55 -53.85 52.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.831 0.348 . . . . 0.0 111.013 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.9 m -79.31 -56.2 4.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.841 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.403 ' N ' ' O ' ' A' ' 51' ' ' CYS . 73.7 m -76.52 -41.46 46.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.437 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -83.84 -152.24 13.62 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.121 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 137.59 -54.51 0.7 Allowed Glycine 0 C--N 1.329 0.174 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.5 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.093 -179.881 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.0 ttm105 . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.61 0.243 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 13.4 Cg_exo -63.39 131.03 30.35 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.125 1.883 . . . . 0.0 111.818 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -50.44 -51.62 45.11 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.43 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 6.4 p90 -51.39 -24.09 4.47 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.466 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 66.2 m -60.0 -19.96 55.26 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.134 0.493 . . . . 0.0 110.683 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.25 -11.54 57.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.43 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 59.0 mt-10 -72.0 119.84 76.75 Favored Pre-proline 0 N--CA 1.461 0.124 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.105 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -88.46 151.63 6.49 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 122.687 2.258 . . . . 0.0 112.033 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.42 ' HG3' ' CE2' ' A' ' 22' ' ' PHE . 73.8 Cg_endo -74.97 -172.14 1.17 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.316 2.011 . . . . 0.0 112.291 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.455 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 1.1 p90 -152.45 156.8 40.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -103.97 75.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.34 -164.59 40.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.535 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 77.72 6.89 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.64 0.257 . . . . 0.0 111.557 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.3 m -158.0 116.38 3.09 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.953 0.406 . . . . 0.0 110.399 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.0 mtp85 -86.62 23.31 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.125 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.18 141.8 41.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.734 0.302 . . . . 0.0 110.969 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -160.49 41.06 0.17 Allowed 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.296 0.569 . . . . 0.0 111.273 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -175.79 80.36 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.468 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -163.4 -55.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mmm-85 -140.02 -177.03 4.81 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 111.965 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -130.47 175.47 8.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.016 -179.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.429 ' CD1' ' O ' ' A' ' 31' ' ' GLN . 19.7 p90 -146.9 150.25 34.85 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.297 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.466 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 84.1 t80 -85.98 134.07 33.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.6 t-20 -104.69 92.28 4.21 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.79 -28.01 32.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.353 . . . . 0.0 111.291 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -1.14 47.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.94 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.48 -2.93 1.55 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.6 -4.35 4.08 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 114.532 0.573 . . . . 0.0 114.532 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -124.37 169.63 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.161 0.481 . . . . 0.0 111.418 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m -101.6 166.0 10.93 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.947 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.429 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -149.57 151.49 33.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.866 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -78.0 137.71 38.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.105 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 38' ' ' CYS . 84.0 m-85 -46.39 106.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.089 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.3 -176.11 2.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.912 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.494 ' C ' ' H ' ' A' ' 37' ' ' ALA . 21.7 p90 -43.72 139.42 2.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.315 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.34 -8.35 0.04 OUTLIER Glycine 0 N--CA 1.438 -1.199 0 N-CA-C 114.65 0.62 . . . . 0.0 114.65 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.494 ' H ' ' C ' ' A' ' 35' ' ' TYR . . . -71.7 105.19 3.62 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 117.597 0.698 . . . . 0.0 111.453 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.455 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -88.11 171.92 9.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.778 0.323 . . . . 0.0 111.036 179.517 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.44 141.26 50.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.82 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.99 174.63 6.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.062 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -62.9 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.607 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.5 mmm-85 -89.99 -34.49 15.97 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.57 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.62 79.11 2.0 Allowed 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.969 0.414 . . . . 0.0 110.972 -177.583 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -157.45 97.54 1.62 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.568 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.509 ' CG ' ' HA ' ' A' ' 51' ' ' CYS . 97.9 m-85 -105.08 140.4 38.31 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.3 -18.11 47.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.851 -178.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.79 151.2 21.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 0.0 111.04 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.54 -38.28 74.46 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -61.38 -38.31 86.54 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.49 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.46 -45.29 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.969 178.252 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.509 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 1.4 t -60.66 -55.38 33.91 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.927 0.394 . . . . 0.0 110.119 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.431 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 71.6 mt -53.3 -43.22 67.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.367 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -52.36 65.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.761 0.315 . . . . 0.0 111.207 -179.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.426 ' HB ' ' CE1' ' A' ' 45' ' ' PHE . 2.9 m -79.16 -57.32 3.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -82.79 -37.21 24.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.431 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -70.06 148.72 46.55 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.437 -0.887 . . . . 0.0 112.744 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -165.73 29.82 0.2 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.379 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.071 179.938 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.615 0.245 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.408 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.9 Cg_exo -63.42 136.23 53.88 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.318 2.012 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -44.29 -61.71 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 33.4 p90 -51.05 -30.2 14.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.408 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 73.6 m -60.79 -20.24 61.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.106 0.479 . . . . 0.0 110.629 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.0 mt -80.25 -13.56 59.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.133 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 32.8 mt-10 -71.86 114.85 32.32 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.014 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.436 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 87.2 Cg_endo -85.0 152.08 11.06 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.46 2.107 . . . . 0.0 112.43 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 14.6 Cg_endo -90.34 -169.11 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.052 2.501 . . . . 0.0 111.671 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.489 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 39.9 p90 -152.33 133.24 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.884 0.373 . . . . 0.0 111.367 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -110.32 111.06 22.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.272 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -160.54 -109.88 0.26 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.49 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.16 78.32 6.83 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.0 m -156.47 175.08 14.49 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.323 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.48 88.41 1.21 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.006 -179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -164.72 142.9 6.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.017 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -159.16 47.05 0.3 Allowed 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.744 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.66 -176.5 1.63 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.943 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.1 63.33 3.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.195 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.452 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 1.5 mtp180 -132.11 164.38 26.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.252 0.548 . . . . 0.0 110.869 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.457 ' N ' ' CD1' ' A' ' 21' ' ' TYR . 2.4 m-85 -143.68 177.95 8.14 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.706 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.43 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 19.1 p90 -149.5 157.33 43.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.031 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CG ' ' HB3' ' A' ' 55' ' ' CYS . 60.6 t80 -84.38 144.39 28.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.927 0.394 . . . . 0.0 111.305 -179.286 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -116.72 89.6 3.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.125 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.15 -24.49 10.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.432 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -3.87 58.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.931 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.27 -2.05 1.86 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.38 -3.26 8.32 Favored Glycine 0 N--CA 1.446 -0.664 0 N-CA-C 114.772 0.669 . . . . 0.0 114.772 178.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.22 175.74 7.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.342 0.571 . . . . 0.0 111.436 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.43 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.5 m -100.79 173.05 6.69 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.265 0.555 . . . . 0.0 111.605 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.13 151.61 34.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.996 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 t -77.42 149.06 35.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.88 0.371 . . . . 0.0 110.726 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.85 111.77 3.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.998 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.29 158.21 36.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.875 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -64.57 65.05 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.205 0.526 . . . . 0.0 111.355 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 171.68 -33.85 0.14 Allowed Glycine 0 N--CA 1.429 -1.813 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.574 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.63 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -65.77 124.15 21.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.489 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -81.93 153.81 26.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.565 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.32 118.38 11.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.244 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.64 168.02 19.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.889 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.407 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 2.7 tttp -60.97 -77.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 24.1 mmm-85 -92.86 -29.35 15.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.935 -179.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.33 72.22 2.36 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.031 0.443 . . . . 0.0 111.03 -177.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 41' ' ' LYS . 5.0 p30 -159.5 101.71 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.496 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.463 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.6 m-85 -107.24 136.57 46.83 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.701 0.286 . . . . 0.0 110.473 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -64.36 -12.33 41.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.494 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -154.44 147.36 24.49 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.905 0.384 . . . . 0.0 111.387 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.93 81.61 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.624 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.421 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 13.6 mt-10 -58.51 -38.44 77.72 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.463 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.12 -46.48 74.03 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.412 ' O ' ' N ' ' A' ' 55' ' ' CYS . 7.7 t -63.72 -54.07 41.17 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.5 0.667 . . . . 0.0 109.591 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.413 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 19.9 mt -53.58 -42.75 67.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.641 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.421 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -61.51 -54.96 36.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 0.0 111.577 -179.537 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 m -77.76 -51.0 11.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.453 ' HB3' ' CG ' ' A' ' 23' ' ' TYR . 99.1 m -87.59 -37.11 17.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.413 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -70.76 83.63 0.38 Allowed Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.014 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.59 26.95 21.87 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.637 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.218 179.937 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.587 0.232 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.406 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 14.8 Cg_exo -65.02 131.96 30.51 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.267 1.978 . . . . 0.0 111.959 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.13 -55.82 9.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -51.03 -27.47 7.98 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.406 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 78.1 m -59.59 -23.82 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.161 0.505 . . . . 0.0 110.378 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mt -80.98 -13.53 58.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.622 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -73.12 117.07 56.97 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.756 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.12 160.46 45.44 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.14 1.893 . . . . 0.0 111.874 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.426 ' HD3' ' CD2' ' A' ' 22' ' ' PHE . 5.9 Cg_exo -41.46 170.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.936 2.424 . . . . 0.0 112.996 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD1' ' N ' ' A' ' 11' ' ' ALA . 37.3 t80 -79.67 166.59 21.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.73 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.499 ' N ' ' CD1' ' A' ' 10' ' ' TYR . . . -137.9 91.61 2.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.198 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.24 -164.06 10.28 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.67 36.0 0.69 Allowed 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.8 m -76.14 156.94 33.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.764 0.316 . . . . 0.0 110.718 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -158.66 103.96 1.76 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.848 0.356 . . . . 0.0 111.294 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 64.99 95.47 0.05 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.61 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -162.57 50.94 0.19 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.118 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.08 123.79 22.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.55 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.0 -48.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.144 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.2 mtm-85 -99.89 179.64 4.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.279 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.47 ' CE1' ' HA ' ' A' ' 47' ' ' SER . 14.8 m-85 -135.63 168.5 19.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.466 ' CZ ' ' HB3' ' A' ' 31' ' ' GLN . 52.0 p90 -145.32 156.79 44.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.353 178.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -85.94 140.54 30.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.922 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -107.53 89.29 2.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.009 179.318 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.84 -25.16 10.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.792 0.33 . . . . 0.0 111.309 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -92.49 1.84 57.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.094 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.69 -1.59 1.63 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 64.35 -4.45 1.37 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -121.89 172.45 8.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 117.236 0.518 . . . . 0.0 111.096 -179.762 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.46 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.2 m -103.29 170.63 7.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.323 0.582 . . . . 0.0 111.194 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.466 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -151.08 143.49 24.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.186 179.74 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.429 ' N ' ' HG3' ' A' ' 31' ' ' GLN . 1.7 t -75.82 130.65 38.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.728 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.413 ' CZ ' ' HB3' ' A' ' 22' ' ' PHE . 64.9 m-85 -55.09 161.3 1.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.071 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.07 -159.28 0.38 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 112.029 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -36.91 140.86 0.14 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.143 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 43.99 38.44 4.66 Favored Glycine 0 N--CA 1.434 -1.444 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.229 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.63 91.61 0.76 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.102 0.477 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.412 ' N ' ' HB3' ' A' ' 10' ' ' TYR . 36.8 m -88.48 174.62 8.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.158 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.09 127.88 33.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.156 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.37 144.68 32.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.943 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -33.78 76.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.669 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -82.76 0.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.553 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.89 103.73 14.21 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.308 0.575 . . . . 0.0 111.596 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -159.15 106.99 1.81 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.883 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.48 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 88.7 m-85 -105.04 136.91 43.65 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.853 0.359 . . . . 0.0 110.866 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.63 -15.1 50.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.576 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.47 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -151.17 146.65 26.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.008 0.433 . . . . 0.0 111.235 179.931 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.434 ' HB1' ' CD2' ' A' ' 21' ' ' TYR . . . -59.49 -38.98 82.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.055 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -60.05 -38.48 82.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.48 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.93 -43.88 86.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.102 178.492 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.429 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 0.7 OUTLIER -62.25 -55.91 23.75 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.511 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.3 mt -55.04 -41.27 71.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.359 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -59.38 -51.34 70.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.828 0.347 . . . . 0.0 110.978 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.442 ' HB ' ' CZ ' ' A' ' 45' ' ' PHE . 7.0 m -80.02 -58.71 3.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.725 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 17.4 m -73.88 -43.99 56.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -64.2 154.91 46.93 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.736 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -170.88 -68.06 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.443 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.238 -0.887 . . . . 0.0 111.608 179.882 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . 0.425 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 9.7 ptp85 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.493 0.187 . . . . 0.0 111.259 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 13.7 Cg_exo -67.77 132.45 26.78 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.437 2.091 . . . . 0.0 112.155 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -58.16 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.5 ' HB2' ' HB2' ' A' ' 42' ' ' ARG . 13.8 p90 -51.3 -26.61 7.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.089 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.448 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 78.5 m -60.08 -19.93 55.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.084 0.468 . . . . 0.0 110.409 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 17.9 mt -81.75 -7.09 59.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.842 179.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.422 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 31.7 mm-40 -71.19 118.83 69.39 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.242 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.422 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 10.0 Cg_exo -70.79 150.43 61.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.5 2.134 . . . . 0.0 112.112 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.4 Cg_endo -80.26 -176.97 3.47 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.744 2.296 . . . . 0.0 111.919 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -153.99 161.46 41.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -134.74 108.4 7.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.11 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 172.74 143.94 4.38 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.454 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 70.63 35.06 1.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 111.337 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.06 165.74 26.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.929 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -159.27 106.06 1.74 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 71.69 101.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.074 178.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -163.02 44.92 0.13 Allowed 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.37 0.605 . . . . 0.0 110.467 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.52 88.98 0.94 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.896 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.64 21.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.23 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -146.13 168.0 22.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.595 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -137.23 173.15 11.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.914 0.388 . . . . 0.0 111.117 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.483 ' CE1' ' HB2' ' A' ' 31' ' ' GLN . 25.7 p90 -147.29 155.13 41.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.448 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -86.57 140.0 30.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -115.48 90.28 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.18 -29.67 33.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -79.05 -2.02 38.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.473 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.65 -1.84 2.01 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.77 -8.6 1.68 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 121.053 -0.594 . . . . 0.0 114.542 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.69 176.86 6.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 117.34 0.57 . . . . 0.0 111.253 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.1 m -97.34 171.43 8.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.335 0.588 . . . . 0.0 111.315 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.483 ' HB2' ' CE1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -146.54 142.46 28.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.601 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 t -75.43 137.9 41.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 110.624 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.501 ' HB3' ' HB1' ' A' ' 37' ' ' ALA . 47.3 m-85 -53.9 124.1 14.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.514 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 37' ' ' ALA . . . -74.97 -171.45 1.34 Allowed 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.067 -179.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -51.36 142.6 13.08 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.878 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 44.8 17.13 0.08 OUTLIER Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 115.556 -0.747 . . . . 0.0 114.92 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 33' ' ' PHE . . . -69.74 -178.97 1.63 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 117.746 0.773 . . . . 0.0 110.321 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.433 ' O ' ' CE1' ' A' ' 33' ' ' PHE . 0.9 OUTLIER -155.17 152.07 28.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.124 0.487 . . . . 0.0 111.41 179.713 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.34 139.84 50.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.236 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -92.99 -174.32 3.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.088 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -80.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.691 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.5 ' HB2' ' HB2' ' A' ' 4' ' ' PHE . 8.4 mmt-85 -87.91 -33.77 18.38 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.21 71.84 2.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.12 0.486 . . . . 0.0 110.447 -178.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -156.02 92.99 1.4 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.668 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.498 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.3 m-85 -107.01 131.02 54.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -12.03 18.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.795 -179.057 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.73 148.95 24.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.921 0.391 . . . . 0.0 111.276 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.11 74.88 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -38.57 84.93 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.498 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -66.57 -46.41 76.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.286 178.594 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.448 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 2.4 t -60.58 -55.58 31.65 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-O 121.028 0.442 . . . . 0.0 110.144 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.407 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 47.7 mt -53.23 -42.54 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.553 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -59.7 -51.78 68.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.829 0.347 . . . . 0.0 111.147 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.0 m -78.66 -58.57 3.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.088 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 23.2 m -76.72 -41.15 46.25 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.407 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -69.0 -77.62 0.38 Allowed Glycine 0 CA--C 1.518 0.24 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.485 -179.564 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -49.64 126.82 21.78 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.544 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.112 179.952 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.616 0.246 . . . . 0.0 111.15 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.98 138.81 81.16 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.287 1.991 . . . . 0.0 112.091 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -61.96 1.41 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.403 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.457 ' HB2' ' CB ' ' A' ' 42' ' ' ARG . 20.4 p90 -51.99 -29.83 22.46 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.6 m -61.65 -18.15 58.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.088 0.47 . . . . 0.0 110.743 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.44 -12.11 59.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.968 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -72.42 114.39 29.32 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.964 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -82.45 149.57 14.83 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.429 2.086 . . . . 0.0 112.192 179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.54 ' HG3' ' CD2' ' A' ' 22' ' ' PHE . 72.9 Cg_endo -94.17 144.78 1.81 Allowed 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.034 2.489 . . . . 0.0 112.556 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -87.84 142.37 27.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.666 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.36 108.36 14.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.145 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.61 143.3 6.11 Favored Glycine 0 C--N 1.33 0.203 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.554 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.91 49.26 4.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 0.0 111.111 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.7 t -165.16 165.54 19.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.126 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -160.44 81.53 0.68 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.86 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -166.49 149.91 7.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.892 0.377 . . . . 0.0 111.569 -179.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . 71.04 62.83 0.17 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.182 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.76 159.32 34.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.301 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 32.42 73.41 0.06 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.046 -0.525 . . . . 0.0 112.353 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.433 ' HB2' ' CD2' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -142.96 179.07 7.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.95 0.405 . . . . 0.0 110.918 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.425 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 46.2 m-85 -128.97 155.15 45.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.987 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.54 ' CD2' ' HG3' ' A' ' 9' ' ' PRO . 18.7 p90 -145.7 152.66 39.95 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.317 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -84.73 139.41 32.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' A' ' 29' ' ' LEU . 35.7 t-20 -112.4 88.06 2.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.345 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.71 -25.47 18.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.227 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -79.75 -4.77 53.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.616 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.3 1.1 1.76 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.73 -6.35 2.79 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 114.826 0.69 . . . . 0.0 114.826 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.422 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 2.3 mp -122.33 174.22 7.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.395 0.597 . . . . 0.0 111.341 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 22' ' ' PHE . 1.9 m -102.81 168.02 9.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.076 0.465 . . . . 0.0 110.936 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 23.5 mt-30 -148.39 156.87 43.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.609 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -79.75 147.8 31.73 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.864 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.457 ' HB3' ' HB1' ' A' ' 37' ' ' ALA . 42.0 m-85 -65.49 117.01 7.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.016 0.436 . . . . 0.0 111.373 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.71 -171.93 1.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.055 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -44.42 134.08 5.31 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.782 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 39.01 26.02 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 114.842 0.697 . . . . 0.0 114.842 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.457 ' HB1' ' HB3' ' A' ' 33' ' ' PHE . . . -69.36 168.39 14.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 117.207 0.503 . . . . 0.0 110.466 179.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 21.1 m -155.64 145.63 21.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 111.911 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -70.09 174.84 4.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 179.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 41' ' ' LYS . . . -124.08 34.01 5.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.894 0.378 . . . . 0.0 111.387 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.486 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER 91.19 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.487 179.149 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.457 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER -88.03 -40.22 14.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.82 -178.867 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.26 72.4 2.32 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.129 0.49 . . . . 0.0 110.521 -177.642 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 16.0 t30 -156.0 93.51 1.45 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.821 -179.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.573 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 99.5 m-85 -105.54 130.2 53.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -63.02 -12.98 29.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.293 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -150.35 145.47 26.14 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.951 0.405 . . . . 0.0 111.391 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.425 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -60.26 -34.58 73.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.596 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.13 -39.2 85.45 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.027 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.573 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -65.13 -47.61 76.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.438 178.661 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.43 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 3.0 t -60.81 -52.95 62.89 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.366 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.4 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 95.5 mt -56.31 -45.12 80.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.485 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.38 91.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.77 0.319 . . . . 0.0 111.097 -179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.4 m -81.05 -62.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -85.49 -29.44 24.27 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.4 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -64.86 -124.38 0.01 OUTLIER Glycine 0 CA--C 1.517 0.179 0 C-N-CA 120.164 -1.017 . . . . 0.0 112.386 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.23 -59.39 4.86 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.336 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.995 179.78 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.6 ptp180 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.373 0.13 . . . . 0.0 111.122 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.409 ' HG2' ' HA ' ' A' ' 55' ' ' CYS . 20.8 Cg_exo -60.91 136.53 66.47 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.991 1.794 . . . . 0.0 111.717 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.11 -56.65 8.45 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -52.05 -23.6 5.48 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.625 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 70.7 m -62.05 -17.48 57.54 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.978 0.418 . . . . 0.0 110.647 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.1 mt -82.93 -14.53 53.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.231 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.63 119.23 74.02 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.195 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -85.98 156.73 10.01 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.656 2.237 . . . . 0.0 112.258 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 91.2 Cg_endo -88.63 -177.84 1.82 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.695 2.264 . . . . 0.0 112.029 179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.448 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 27.4 p90 -152.94 152.07 31.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.914 0.388 . . . . 0.0 111.115 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -125.48 124.07 40.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.337 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -178.45 89.08 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.189 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.49 94.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.852 0.358 . . . . 0.0 111.186 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.2 m -162.34 171.72 16.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.591 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.98 171.1 20.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.05 -179.722 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 80.03 90.36 0.05 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.446 179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -160.85 64.9 0.3 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.958 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.89 82.85 0.65 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.208 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 56.59 92.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.526 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.52 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -137.47 166.42 23.91 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.434 178.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -136.07 165.48 25.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 111.755 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.488 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 12.5 p90 -144.53 153.08 41.46 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.56 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.625 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 82.9 t80 -84.43 139.71 32.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.158 0.504 . . . . 0.0 111.707 -178.772 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -115.62 90.15 3.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.024 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.424 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . . . -52.74 -28.53 22.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.8 0.333 . . . . 0.0 111.356 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -1.84 37.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.611 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.69 -3.07 1.5 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.98 -3.73 3.78 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.57 172.8 9.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.231 0.516 . . . . 0.0 111.39 -179.597 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 2.0 m -100.41 170.11 8.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.074 0.464 . . . . 0.0 111.485 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.446 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -147.99 151.51 35.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.444 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.52 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 1.5 t -74.22 147.18 42.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.429 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -74.72 131.15 40.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.559 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.452 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.52 157.68 37.15 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.64 64.13 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.205 0.526 . . . . 0.0 110.822 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.452 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 168.77 -27.95 0.14 Allowed Glycine 0 N--CA 1.429 -1.805 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.362 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.459 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -63.35 129.99 42.6 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.932 0.396 . . . . 0.0 111.656 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.448 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 13.6 m -83.5 149.62 26.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.976 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.65 164.01 24.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.781 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -112.72 168.15 9.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.113 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -63.78 -75.35 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.593 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 -86.26 -31.9 21.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.484 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.433 ' O ' ' HB3' ' A' ' 44' ' ' ASN . 0.5 OUTLIER -73.79 -177.01 2.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.13 0.49 . . . . 0.0 109.955 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . 0.433 ' HB3' ' O ' ' A' ' 43' ' ' ASN . 56.5 t-20 74.0 115.65 0.06 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.62 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.423 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 64.2 m-85 -119.41 144.48 46.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.756 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -16.3 59.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.621 0.248 . . . . 0.0 111.434 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.85 146.21 25.51 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 111.32 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.77 81.03 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.092 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.438 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 2.0 tt0 -58.68 -39.86 81.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.423 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.56 -43.22 90.52 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.398 178.473 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.404 ' O ' ' N ' ' A' ' 55' ' ' CYS . 3.6 t -62.22 -58.19 8.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.16 0.505 . . . . 0.0 109.867 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.76 -44.97 70.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.846 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . 0.438 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -59.36 -50.39 74.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.735 0.303 . . . . 0.0 111.206 -179.376 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -78.29 -61.25 2.07 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.409 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.8 OUTLIER -74.54 -41.37 60.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -69.35 -92.89 0.06 OUTLIER Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.396 -0.907 . . . . 0.0 112.445 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.67 90.77 0.05 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.442 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.004 179.925 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.556 0.217 . . . . 0.0 111.12 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -52.97 132.77 48.98 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.055 1.837 . . . . 0.0 111.768 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -47.74 -51.92 20.42 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.405 ' CB ' ' HG3' ' A' ' 42' ' ' ARG . 2.8 p90 -52.23 -22.32 4.27 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.837 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.526 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.6 m -57.78 -20.29 34.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.167 0.508 . . . . 0.0 110.428 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.5 mt -82.21 -17.55 45.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.145 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . 0.402 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 28.7 tp10 -75.45 111.43 14.09 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.454 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.402 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 36.9 Cg_endo -94.18 158.71 2.12 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 122.955 2.436 . . . . 0.0 112.292 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.94 -162.74 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.627 2.218 . . . . 0.0 112.095 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.505 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 18.6 p90 -150.21 144.92 25.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -110.55 115.14 29.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.848 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.37 138.62 3.05 Favored Glycine 0 C--N 1.328 0.111 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.211 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.38 45.4 8.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.046 0.451 . . . . 0.0 110.392 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.709 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 0.5 OUTLIER -161.86 177.21 10.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.041 -179.3 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.417 ' HG3' ' O ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -147.89 -171.69 3.88 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.009 0.433 . . . . 0.0 111.455 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.85 117.84 12.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.486 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -160.6 60.33 0.32 Allowed 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.262 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.17 137.09 57.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.293 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.21 -39.67 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.049 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.72 -177.79 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.22 0.533 . . . . 0.0 111.068 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -131.97 166.87 20.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.972 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -143.27 152.57 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.468 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.526 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 78.4 t80 -86.74 143.46 27.54 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.994 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . 0.402 ' HB3' ' HB3' ' A' ' 27' ' ' ALA . 51.9 t-20 -115.01 102.07 9.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.621 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.8 -27.0 59.2 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.31 -13.63 43.08 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.402 ' HB3' ' HB3' ' A' ' 24' ' ' ASN . . . -115.04 -14.03 11.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.62 0.248 . . . . 0.0 111.664 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.68 -6.44 25.1 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 121.066 -0.587 . . . . 0.0 113.721 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 mp -127.69 176.61 7.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 0.0 110.796 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 m -101.61 168.17 9.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.256 0.551 . . . . 0.0 111.204 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -152.17 145.13 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.311 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.52 145.84 32.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.559 ' CE2' ' HA ' ' A' ' 39' ' ' ALA . 78.7 m-85 -58.61 134.47 56.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.446 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -164.68 171.89 13.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.793 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.1 t80 54.71 62.54 2.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.345 0.593 . . . . 0.0 110.394 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.709 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . 52.4 5.82 0.23 Allowed Glycine 0 N--CA 1.436 -1.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 114.407 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.81 126.12 26.96 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.076 0.938 . . . . 0.0 111.122 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.505 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -85.49 174.51 9.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.511 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.559 ' HA ' ' CE2' ' A' ' 33' ' ' PHE . . . -72.3 129.49 38.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.597 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.0 165.45 24.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.435 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -62.5 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.196 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.405 ' HG3' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -93.77 -24.72 17.69 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.13 79.3 2.27 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.95 0.405 . . . . 0.0 110.377 -178.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -155.52 105.48 2.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.514 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.479 ' CD2' ' HB2' ' A' ' 51' ' ' CYS . 86.8 m-85 -103.47 140.53 37.37 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.02 -15.3 30.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.783 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -165.85 154.33 11.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.896 0.379 . . . . 0.0 111.08 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.16 -38.08 75.93 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -60.32 -36.71 78.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -49.11 65.63 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.562 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.479 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 19.0 t -62.27 -55.63 26.45 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.891 0.377 . . . . 0.0 110.558 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . 0.497 ' HA ' ' HA3' ' A' ' 56' ' ' GLY . 79.5 mt -51.77 -52.59 47.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.85 -35.28 70.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.816 0.341 . . . . 0.0 110.77 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -80.07 -70.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.798 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.1 t -96.89 -23.07 16.52 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . 0.497 ' HA3' ' HA ' ' A' ' 52' ' ' LEU . . . -47.67 98.49 0.02 OUTLIER Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.926 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -134.01 -168.56 11.83 Favored Glycine 0 N--CA 1.454 -0.137 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.286 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.246 -0.883 . . . . 0.0 111.576 -179.829 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.415 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 16.6 Cg_exo -61.91 135.16 53.95 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.021 1.814 . . . . 0.0 111.888 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.19 -58.46 4.5 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . 0.477 ' HB3' ' HB3' ' A' ' 42' ' ' ARG . 8.2 p90 -49.93 -25.07 2.91 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.631 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.1 m -60.88 -26.18 67.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.123 0.487 . . . . 0.0 110.523 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 mt -83.63 -13.22 54.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.92 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.49 114.89 33.93 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.413 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -93.79 153.71 2.3 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.01 2.474 . . . . 0.0 112.089 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -78.13 147.26 23.39 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.398 2.065 . . . . 0.0 112.255 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.526 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 10.4 p90 -84.69 130.01 34.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -97.86 88.06 4.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 154.01 152.71 6.16 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.572 -0.823 . . . . 0.0 112.498 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 58.96 37.48 24.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.914 0.388 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.46 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 48.0 t -162.99 161.52 25.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.383 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.61 134.47 8.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.893 0.378 . . . . 0.0 111.608 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.19 119.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.632 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -161.78 44.7 0.16 Allowed 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.299 0.571 . . . . 0.0 110.839 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.4 ' O ' ' HG3' ' A' ' 20' ' ' ARG . . . -68.72 -169.25 0.15 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.749 -179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 47.03 25.52 0.5 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.211 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.436 ' HB2' ' CD1' ' A' ' 33' ' ' PHE . 6.6 mtp85 -142.38 158.42 43.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 111.038 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.407 ' N ' ' CD1' ' A' ' 21' ' ' TYR . 3.1 m-85 -140.91 172.33 12.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.211 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 23.9 p90 -150.6 156.28 41.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.113 178.443 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.631 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -83.42 138.27 33.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.072 0.463 . . . . 0.0 110.965 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -105.4 91.39 3.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.319 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.57 -22.81 9.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.61 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.19 -1.6 57.68 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.59 -3.6 1.87 Allowed 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.404 ' HA2' ' OH ' ' A' ' 23' ' ' TYR . . . 70.44 -7.73 4.65 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 114.882 0.713 . . . . 0.0 114.882 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.1 mp -123.52 171.37 9.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.488 0.644 . . . . 0.0 111.674 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 1.4 m -101.68 164.27 11.83 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-O 121.386 0.612 . . . . 0.0 111.196 179.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -149.72 160.92 43.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.97 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 t -75.11 156.56 35.89 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.646 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.436 ' CD1' ' HB2' ' A' ' 20' ' ' ARG . 76.5 m-85 -72.89 98.68 2.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.255 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.531 ' O ' ' HB1' ' A' ' 37' ' ' ALA . . . -77.08 164.0 26.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.708 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.477 ' C ' ' H ' ' A' ' 37' ' ' ALA . 19.9 p90 41.56 -169.9 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.538 0.685 . . . . 0.0 111.299 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.46 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . -65.06 28.38 0.11 Allowed Glycine 0 C--N 1.311 -0.819 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.12 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.531 ' HB1' ' O ' ' A' ' 34' ' ' ALA . . . -67.15 128.3 35.87 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 118.449 1.124 . . . . 0.0 110.83 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.526 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 0.3 OUTLIER -84.17 165.01 18.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.056 0.455 . . . . 0.0 111.468 -179.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.98 136.72 46.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.412 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.37 152.93 44.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.865 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.28 -65.45 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.477 ' HB3' ' HB3' ' A' ' 4' ' ' PHE . 5.3 mtp180 -88.8 -54.05 4.33 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.472 ' O ' ' ND2' ' A' ' 43' ' ' ASN . 0.0 OUTLIER -84.6 96.94 9.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.571 0.7 . . . . 0.0 111.049 -178.924 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -156.81 95.49 1.53 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.668 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.502 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 85.0 m-85 -103.76 128.6 51.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.78 0.324 . . . . 0.0 110.911 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mttt -63.43 -13.49 40.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.923 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.32 142.41 33.84 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.017 0.437 . . . . 0.0 111.127 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.402 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -61.98 -38.17 87.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.336 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -58.99 -38.62 79.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.502 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -65.65 -44.05 87.54 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.201 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 55' ' ' CYS . 2.0 t -61.43 -55.34 32.48 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 88.7 mt -53.26 -42.93 66.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.293 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.51 79.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.864 0.364 . . . . 0.0 110.515 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.483 ' HB ' ' CZ ' ' A' ' 45' ' ' PHE . 8.0 m -80.13 -62.89 1.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.835 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.451 ' N ' ' O ' ' A' ' 51' ' ' CYS . 1.5 m -72.12 -44.69 62.78 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.52 -66.33 2.91 Favored Glycine 0 CA--C 1.518 0.235 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.681 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -62.58 -104.97 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.463 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.033 -179.875 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.664 0.269 . . . . 0.0 111.247 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HG2' ' HA ' ' A' ' 55' ' ' CYS . 25.5 Cg_exo -58.14 152.09 54.63 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.239 1.959 . . . . 0.0 112.041 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -49.03 -61.31 2.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.673 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -55.12 -22.98 18.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.71 0.291 . . . . 0.0 111.245 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' CYS . . . . . 0.453 ' SG ' ' CD2' ' A' ' 23' ' ' TYR . 0.1 OUTLIER -60.46 -20.05 58.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.149 0.5 . . . . 0.0 109.964 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 16.5 mt -82.13 -17.06 47.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.409 178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.35 114.21 27.66 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.007 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -85.37 156.71 10.88 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.572 2.182 . . . . 0.0 112.248 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . 0.524 ' HG3' ' CD1' ' A' ' 22' ' ' PHE . 62.7 Cg_endo -85.87 176.15 5.49 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.636 2.224 . . . . 0.0 111.408 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.44 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 1.1 p90 -155.74 149.73 25.45 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 111.771 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -117.62 107.79 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.46 -115.32 0.95 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.256 -0.973 . . . . 0.0 113.719 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . 0.411 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -75.55 77.75 2.57 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -178.337 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 13' ' ' ALA . 88.0 m -159.84 179.0 9.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.031 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 -156.45 104.01 2.17 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.895 0.379 . . . . 0.0 111.525 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 63.03 130.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.532 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -161.45 45.8 0.18 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.704 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.29 -174.08 0.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.206 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 68.61 16.98 9.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.277 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -142.85 167.87 21.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.463 0.649 . . . . 0.0 111.216 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.401 ' CZ ' HG22 ' A' ' 32' ' ' THR . 61.6 m-85 -139.65 167.14 22.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.156 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PHE . . . . . 0.524 ' CD1' ' HG3' ' A' ' 9' ' ' PRO . 13.6 p90 -149.14 146.65 27.78 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.477 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CD2' ' SG ' ' A' ' 5' ' ' CYS . 83.5 t80 -83.93 132.07 34.8 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.922 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -102.23 98.1 8.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.502 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.409 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . . . -53.57 -33.12 53.63 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.385 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -83.23 3.35 31.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.953 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.53 -4.76 1.81 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.28 -6.62 2.22 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.886 0.715 . . . . 0.0 114.886 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.45 171.55 11.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.524 0.662 . . . . 0.0 111.225 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 1.6 m -96.35 168.39 10.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.114 0.483 . . . . 0.0 111.197 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.483 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 4.0 tt0 -147.62 152.71 38.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.737 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.401 HG22 ' CZ ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -76.62 134.46 39.32 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.821 179.078 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -61.01 166.63 3.39 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -168.52 -152.32 0.11 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.801 -179.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.463 ' C ' ' H ' ' A' ' 37' ' ' ALA . 12.9 t80 -39.51 121.69 1.24 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.42 ' O ' ' HA ' ' A' ' 11' ' ' ALA . . . 54.17 -2.92 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.167 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ALA . . . . . 0.573 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -67.44 106.82 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.967 0.883 . . . . 0.0 110.881 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.44 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 70.8 m -82.82 145.23 29.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.45 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 138.69 49.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.226 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -87.84 164.4 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.794 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -71.73 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.651 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -86.12 -38.74 17.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.068 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.62 70.04 2.4 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 121.229 0.538 . . . . 0.0 110.306 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -155.77 92.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.165 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.548 ' CG ' ' HA ' ' A' ' 51' ' ' CYS . 81.2 m-85 -106.29 134.47 49.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 110.662 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -13.75 25.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.021 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.66 150.84 26.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 0.0 111.095 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.37 -38.98 78.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -37.88 81.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . 0.476 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.22 -42.98 83.14 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.288 178.597 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.548 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 5.3 t -63.83 -59.76 4.13 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 121.159 0.504 . . . . 0.0 109.815 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -52.64 -42.28 64.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.436 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -59.16 -51.69 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.825 0.345 . . . . 0.0 111.181 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.453 ' HB ' ' CE1' ' A' ' 45' ' ' PHE . 2.0 m -79.96 -59.92 2.54 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.467 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' CYS . . . . . 0.454 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -69.63 -47.77 62.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.866 -178.846 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 45.72 -167.84 0.04 OUTLIER Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.582 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -175.79 -179.67 46.43 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.774 179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.224 -0.894 . . . . 0.0 111.144 179.953 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.577 0.227 . . . . 0.0 111.035 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.563 ' HG2' HG22 ' A' ' 54' ' ' THR . 37.9 Cg_exo -58.09 136.42 74.81 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.405 2.07 . . . . 0.0 112.368 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.56 -60.02 2.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.449 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 27.3 p90 -51.66 -29.83 19.45 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 2' ' ' PRO . 66.9 m -59.46 -21.03 59.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.012 0.434 . . . . 0.0 110.699 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.4 mt -81.86 -11.39 58.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.225 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.449 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 6.8 mt-10 -72.24 114.88 33.34 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.539 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.9 158.19 7.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 111.896 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.461 ' HG3' ' CZ ' ' A' ' 22' ' ' PHE . 95.0 Cg_endo -77.12 143.08 22.32 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.318 2.012 . . . . 0.0 112.371 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.532 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 27.8 p90 -87.94 130.63 34.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.912 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.24 94.0 6.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.265 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -118.61 -95.73 1.71 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.323 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -161.89 97.96 1.06 Allowed 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 120.849 0.357 . . . . 0.0 111.44 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.782 179.603 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.702 0.287 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -102.02 164.01 11.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.129 0.49 . . . . 0.0 111.237 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.82 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 48.6 m-85 -136.84 156.69 48.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.965 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.552 ' HB2' ' OD1' ' A' ' 43' ' ' ASN . 8.3 p90 -144.42 159.9 41.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.56 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -86.74 145.15 26.76 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.692 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 29' ' ' LEU . 37.0 t-20 -114.26 87.95 2.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.648 178.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.23 -23.84 6.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.673 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.68 -0.96 57.8 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.43 -1.94 1.28 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 -3.29 4.28 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 121.04 -0.6 . . . . 0.0 114.515 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -118.76 171.93 7.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.088 0.444 . . . . 0.0 111.016 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 11.7 m -100.86 177.66 4.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.256 0.55 . . . . 0.0 111.267 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 2.7 tp60 -149.39 138.7 21.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.358 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 5.2 t -83.23 31.8 0.45 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.38 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.444 ' CE1' ' HA ' ' A' ' 39' ' ' ALA . 90.4 m-85 65.48 159.63 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.393 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -167.12 172.71 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.624 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 43.75 -165.6 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.439 0.637 . . . . 0.0 110.7 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.29 22.11 0.82 Allowed Glycine 0 C--N 1.311 -0.835 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.818 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.61 130.92 44.99 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 117.402 0.601 . . . . 0.0 110.956 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.532 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 1.2 m -84.21 153.76 23.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.159 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.444 ' HA ' ' CE1' ' A' ' 33' ' ' PHE . . . -69.42 132.48 46.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.949 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 43' ' ' ASN . . . -80.82 151.12 28.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.219 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -65.42 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.973 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 10.1 mmp_? -85.46 -42.25 14.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.45 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.552 ' OD1' ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.93 69.61 1.9 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.161 0.505 . . . . 0.0 110.408 -177.858 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.3 p-10 -156.44 105.71 2.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.261 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.506 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 83.3 m-85 -108.77 143.09 38.37 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.817 0.341 . . . . 0.0 110.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -63.39 -16.59 60.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.472 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -154.54 147.88 24.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.901 0.381 . . . . 0.0 111.164 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.82 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -59.44 -37.43 78.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.81 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 55.1 tt0 -60.54 -38.69 85.3 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.011 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.506 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -64.63 -45.31 87.4 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.203 178.434 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 5.1 t -61.01 -54.82 40.2 Favored 'General case' 0 C--N 1.339 0.114 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.446 HD23 ' SG ' ' A' ' 30' ' ' CYS . 95.3 mt -56.39 -38.23 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.381 179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 8.2 ttp180 -60.55 -53.85 52.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.831 0.348 . . . . 0.0 111.013 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.563 HG22 ' HG2' ' A' ' 2' ' ' PRO . 18.9 m -79.31 -56.2 4.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.841 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.7 m -76.52 -41.46 46.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.437 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.226 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.121 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.0 ttm105 . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.61 0.243 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 4' ' ' PHE . 13.4 Cg_exo -63.39 131.03 30.35 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.125 1.883 . . . . 0.0 111.818 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -50.44 -51.62 45.11 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.442 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 6.4 p90 -51.39 -24.09 4.47 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 66.2 m -60.0 -19.96 55.26 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.134 0.493 . . . . 0.0 110.683 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.25 -11.54 57.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.442 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 59.0 mt-10 -72.0 119.84 76.75 Favored Pre-proline 0 N--CA 1.461 0.124 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.105 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -88.46 151.63 6.49 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 122.687 2.258 . . . . 0.0 112.033 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.435 ' HG3' ' CE2' ' A' ' 22' ' ' PHE . 73.8 Cg_endo -74.97 -172.14 1.17 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.316 2.011 . . . . 0.0 112.291 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 1.1 p90 -152.45 156.8 40.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -103.97 75.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.34 -164.59 40.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.535 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 77.72 6.89 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.64 0.257 . . . . 0.0 111.557 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.463 0.221 0 CA-C-O 120.953 0.406 . . . . 0.0 110.399 179.859 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mmm-85 -140.02 -177.03 4.81 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 111.965 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.558 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 10.0 m-85 -130.47 175.47 8.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.016 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.435 ' CE2' ' HG3' ' A' ' 9' ' ' PRO . 19.7 p90 -146.9 150.25 34.85 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.297 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.473 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 84.1 t80 -85.98 134.07 33.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.6 t-20 -104.69 92.28 4.21 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.79 -28.01 32.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.353 . . . . 0.0 111.291 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -1.14 47.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.94 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.48 -2.93 1.55 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.6 -4.35 4.08 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 114.532 0.573 . . . . 0.0 114.532 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -124.37 169.63 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.161 0.481 . . . . 0.0 111.418 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m -101.6 166.0 10.93 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.947 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.429 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -149.57 151.49 33.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.866 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -78.0 137.71 38.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.105 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 38' ' ' CYS . 84.0 m-85 -46.39 106.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.089 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.496 ' O ' ' HB3' ' A' ' 37' ' ' ALA . . . -74.3 -176.11 2.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.912 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.461 ' C ' ' H ' ' A' ' 37' ' ' ALA . 21.7 p90 -43.72 139.42 2.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.315 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.34 -8.35 0.04 OUTLIER Glycine 0 N--CA 1.438 -1.199 0 N-CA-C 114.65 0.62 . . . . 0.0 114.65 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 34' ' ' ALA . . . -71.7 105.19 3.62 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 117.597 0.698 . . . . 0.0 111.453 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -88.11 171.92 9.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.778 0.323 . . . . 0.0 111.036 179.517 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.44 141.26 50.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.82 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.99 174.63 6.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.062 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -62.9 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.607 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.5 mmm-85 -89.99 -34.49 15.97 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.57 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.62 79.11 2.0 Allowed 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.969 0.414 . . . . 0.0 110.972 -177.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -157.45 97.54 1.62 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.568 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 97.9 m-85 -105.08 140.4 38.31 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.3 -18.11 47.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.851 -178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.79 151.2 21.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 0.0 111.04 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.558 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -57.54 -38.28 74.46 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -61.38 -38.31 86.54 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.665 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.513 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.46 -45.29 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.969 178.252 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 1.4 t -60.66 -55.38 33.91 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.927 0.394 . . . . 0.0 110.119 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.431 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 71.6 mt -53.3 -43.22 67.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.367 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -52.36 65.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.761 0.315 . . . . 0.0 111.207 -179.595 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.9 m -79.16 -57.32 3.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -82.79 -37.21 24.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.431 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.223 0 C-N-CA 120.437 -0.887 . . . . 0.0 112.744 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.409 ' HG3' HD21 ' A' ' 6' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.615 0.245 . . . . 0.0 111.195 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.414 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.9 Cg_exo -63.42 136.23 53.88 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.318 2.012 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -44.29 -61.71 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.415 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 33.4 p90 -51.05 -30.2 14.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 73.6 m -60.79 -20.24 61.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.106 0.479 . . . . 0.0 110.629 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.409 HD21 ' HG3' ' A' ' 1' ' ' ARG . 13.0 mt -80.25 -13.56 59.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.133 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.415 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 32.8 mt-10 -71.86 114.85 32.32 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.014 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 87.2 Cg_endo -85.0 152.08 11.06 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.46 2.107 . . . . 0.0 112.43 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 14.6 Cg_endo -90.34 -169.11 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.052 2.501 . . . . 0.0 111.671 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.498 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 39.9 p90 -152.33 133.24 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.884 0.373 . . . . 0.0 111.367 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -110.32 111.06 22.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.272 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -160.54 -109.88 0.26 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.49 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.16 78.32 6.83 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.0 m . . . . . 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.323 179.339 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.683 0.278 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.452 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 1.5 mtp180 -132.11 164.38 26.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.252 0.548 . . . . 0.0 110.869 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CD1' ' N ' ' A' ' 21' ' ' TYR . 2.4 m-85 -143.68 177.95 8.14 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.706 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 19.1 p90 -149.5 157.33 43.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.031 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.471 ' CG ' ' HB3' ' A' ' 55' ' ' CYS . 60.6 t80 -84.38 144.39 28.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.927 0.394 . . . . 0.0 111.305 -179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -116.72 89.6 3.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.125 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.15 -24.49 10.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.432 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -3.87 58.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.931 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.27 -2.05 1.86 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.38 -3.26 8.32 Favored Glycine 0 N--CA 1.446 -0.664 0 N-CA-C 114.772 0.669 . . . . 0.0 114.772 178.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.22 175.74 7.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.342 0.571 . . . . 0.0 111.436 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.5 m -100.79 173.05 6.69 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.265 0.555 . . . . 0.0 111.605 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.13 151.61 34.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.996 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 t -77.42 149.06 35.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.88 0.371 . . . . 0.0 110.726 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.85 111.77 3.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.998 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.29 158.21 36.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.875 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -64.57 65.05 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.205 0.526 . . . . 0.0 111.355 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 171.68 -33.85 0.14 Allowed Glycine 0 N--CA 1.429 -1.813 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.574 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.64 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -65.77 124.15 21.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.498 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -81.93 153.81 26.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.565 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.32 118.38 11.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.244 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.64 168.02 19.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.889 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.407 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 2.7 tttp -60.97 -77.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.405 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 24.1 mmm-85 -92.86 -29.35 15.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.935 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.33 72.22 2.36 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.031 0.443 . . . . 0.0 111.03 -177.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 41' ' ' LYS . 5.0 p30 -159.5 101.71 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.496 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.6 m-85 -107.24 136.57 46.83 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.701 0.286 . . . . 0.0 110.473 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -64.36 -12.33 41.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.494 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -154.44 147.36 24.49 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.905 0.384 . . . . 0.0 111.387 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.93 81.61 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.624 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 13.6 mt-10 -58.51 -38.44 77.72 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.483 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.12 -46.48 74.03 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.412 ' O ' ' N ' ' A' ' 55' ' ' CYS . 7.7 t -63.72 -54.07 41.17 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.5 0.667 . . . . 0.0 109.591 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.413 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 19.9 mt -53.58 -42.75 67.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.641 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -61.51 -54.96 36.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 0.0 111.577 -179.537 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 m -77.76 -51.0 11.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.471 ' HB3' ' CG ' ' A' ' 23' ' ' TYR . 99.1 m -87.59 -37.11 17.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.413 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.273 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.014 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.587 0.232 . . . . 0.0 111.166 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 14.8 Cg_exo -65.02 131.96 30.51 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.267 1.978 . . . . 0.0 111.959 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.13 -55.82 9.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -51.03 -27.47 7.98 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 78.1 m -59.59 -23.82 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.161 0.505 . . . . 0.0 110.378 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mt -80.98 -13.53 58.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.622 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -73.12 117.07 56.97 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.756 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.12 160.46 45.44 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.14 1.893 . . . . 0.0 111.874 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HD3' ' CD2' ' A' ' 22' ' ' PHE . 5.9 Cg_exo -41.46 170.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.936 2.424 . . . . 0.0 112.996 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD1' ' N ' ' A' ' 11' ' ' ALA . 37.3 t80 -79.67 166.59 21.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.73 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.499 ' N ' ' CD1' ' A' ' 10' ' ' TYR . . . -137.9 91.61 2.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.198 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.24 -164.06 10.28 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.67 36.0 0.69 Allowed 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.764 0.316 . . . . 0.0 110.718 179.973 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.877 0.37 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 32' ' ' THR . 4.2 mtm-85 -99.89 179.64 4.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.279 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.748 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 14.8 m-85 -135.63 168.5 19.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.468 ' CZ ' ' HB3' ' A' ' 31' ' ' GLN . 52.0 p90 -145.32 156.79 44.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.353 178.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -85.94 140.54 30.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.922 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.509 ' CG ' ' HB3' ' A' ' 27' ' ' ALA . 50.0 t-20 -107.53 89.29 2.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.009 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.84 -25.16 10.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.792 0.33 . . . . 0.0 111.309 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -92.49 1.84 57.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.094 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.509 ' HB3' ' CG ' ' A' ' 24' ' ' ASN . . . -139.69 -1.59 1.63 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 64.35 -4.45 1.37 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 0.1 OUTLIER -121.89 172.45 8.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 117.236 0.518 . . . . 0.0 111.096 -179.762 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.2 m -103.29 170.63 7.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.323 0.582 . . . . 0.0 111.194 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -151.08 143.49 24.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.186 179.74 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.433 ' N ' ' HG3' ' A' ' 31' ' ' GLN . 1.7 t -75.82 130.65 38.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.728 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 22' ' ' PHE . 64.9 m-85 -55.09 161.3 1.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.071 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.07 -159.28 0.38 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 112.029 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -36.91 140.86 0.14 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.143 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 43.99 38.44 4.66 Favored Glycine 0 N--CA 1.434 -1.444 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.229 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.63 91.61 0.76 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.102 0.477 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.429 ' N ' ' HB3' ' A' ' 10' ' ' TYR . 36.8 m -88.48 174.62 8.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.158 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.09 127.88 33.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.156 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.37 144.68 32.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.943 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -33.78 76.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.669 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -82.76 0.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.553 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.89 103.73 14.21 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.308 0.575 . . . . 0.0 111.596 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -159.15 106.99 1.81 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.883 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.501 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 88.7 m-85 -105.04 136.91 43.65 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.853 0.359 . . . . 0.0 110.866 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.63 -15.1 50.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.576 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.483 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -151.17 146.65 26.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.008 0.433 . . . . 0.0 111.235 179.931 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.748 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -59.49 -38.98 82.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.055 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -60.05 -38.48 82.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.501 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.93 -43.88 86.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.102 178.492 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER -62.25 -55.91 23.75 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.511 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.3 mt -55.04 -41.27 71.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.359 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -59.38 -51.34 70.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.828 0.347 . . . . 0.0 110.978 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.4 ' HB ' ' CZ ' ' A' ' 45' ' ' PHE . 7.0 m -80.02 -58.71 3.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.725 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 17.4 m -73.88 -43.99 56.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.736 -179.356 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 9.7 ptp85 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.493 0.187 . . . . 0.0 111.259 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 13.7 Cg_exo -67.77 132.45 26.78 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.437 2.091 . . . . 0.0 112.155 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -58.16 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.529 ' HB2' ' HB2' ' A' ' 42' ' ' ARG . 13.8 p90 -51.3 -26.61 7.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.089 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 78.5 m -60.08 -19.93 55.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.084 0.468 . . . . 0.0 110.409 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.404 HD21 ' HD2' ' A' ' 1' ' ' ARG . 17.9 mt -81.75 -7.09 59.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.842 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.443 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 31.7 mm-40 -71.19 118.83 69.39 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.242 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 10.0 Cg_exo -70.79 150.43 61.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.5 2.134 . . . . 0.0 112.112 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.4 Cg_endo -80.26 -176.97 3.47 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.744 2.296 . . . . 0.0 111.919 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -153.99 161.46 41.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.41 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -134.74 108.4 7.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.11 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 13' ' ' ALA . . . 172.74 143.94 4.38 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.454 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 12' ' ' GLY . . . 70.63 35.06 1.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 111.337 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.929 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.655 0.264 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -146.13 168.0 22.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.595 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -137.23 173.15 11.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.914 0.388 . . . . 0.0 111.117 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.507 ' CE1' ' HB2' ' A' ' 31' ' ' GLN . 25.7 p90 -147.29 155.13 41.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.473 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -86.57 140.0 30.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -115.48 90.28 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.18 -29.67 33.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -79.05 -2.02 38.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.473 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.65 -1.84 2.01 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.77 -8.6 1.68 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 121.053 -0.594 . . . . 0.0 114.542 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.69 176.86 6.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 117.34 0.57 . . . . 0.0 111.253 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.1 m -97.34 171.43 8.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.335 0.588 . . . . 0.0 111.315 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.507 ' HB2' ' CE1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -146.54 142.46 28.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.601 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 t -75.43 137.9 41.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 110.624 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.467 ' HB3' ' HB3' ' A' ' 37' ' ' ALA . 47.3 m-85 -53.9 124.1 14.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.514 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.97 -171.45 1.34 Allowed 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.067 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -51.36 142.6 13.08 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.878 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 44.8 17.13 0.08 OUTLIER Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 115.556 -0.747 . . . . 0.0 114.92 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.467 ' HB3' ' HB3' ' A' ' 33' ' ' PHE . . . -69.74 -178.97 1.63 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 117.746 0.773 . . . . 0.0 110.321 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.433 ' O ' ' CE1' ' A' ' 33' ' ' PHE . 0.9 OUTLIER -155.17 152.07 28.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.124 0.487 . . . . 0.0 111.41 179.713 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.34 139.84 50.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.236 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -92.99 -174.32 3.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.088 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -80.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.691 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.529 ' HB2' ' HB2' ' A' ' 4' ' ' PHE . 8.4 mmt-85 -87.91 -33.77 18.38 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.21 71.84 2.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.12 0.486 . . . . 0.0 110.447 -178.31 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -156.02 92.99 1.4 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.668 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.523 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.3 m-85 -107.01 131.02 54.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -12.03 18.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.795 -179.057 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.73 148.95 24.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.921 0.391 . . . . 0.0 111.276 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.11 74.88 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -38.57 84.93 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.523 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -66.57 -46.41 76.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.286 178.594 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.444 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 2.4 t -60.58 -55.58 31.65 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-O 121.028 0.442 . . . . 0.0 110.144 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.407 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 47.7 mt -53.23 -42.54 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.553 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -59.7 -51.78 68.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.829 0.347 . . . . 0.0 111.147 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.0 m -78.66 -58.57 3.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.088 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 23.2 m -76.72 -41.15 46.25 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.407 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.24 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.485 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.616 0.246 . . . . 0.0 111.15 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.98 138.81 81.16 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.287 1.991 . . . . 0.0 112.091 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -61.96 1.41 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.403 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.473 ' HB2' ' CB ' ' A' ' 42' ' ' ARG . 20.4 p90 -51.99 -29.83 22.46 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.6 m -61.65 -18.15 58.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.088 0.47 . . . . 0.0 110.743 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.44 -12.11 59.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.968 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -72.42 114.39 29.32 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.964 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 93.7 Cg_endo -82.45 149.57 14.83 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.429 2.086 . . . . 0.0 112.192 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.572 ' HG3' ' CD2' ' A' ' 22' ' ' PHE . 72.9 Cg_endo -94.17 144.78 1.81 Allowed 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.034 2.489 . . . . 0.0 112.556 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -87.84 142.37 27.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.666 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.36 108.36 14.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.145 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.61 143.3 6.11 Favored Glycine 0 C--N 1.33 0.203 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.554 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.91 49.26 4.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 0.0 111.111 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.7 t . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.126 -179.739 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.35 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.455 ' HB2' ' CD2' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -142.96 179.07 7.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.95 0.405 . . . . 0.0 110.918 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.711 ' CE2' ' HB2' ' A' ' 48' ' ' ALA . 46.2 m-85 -128.97 155.15 45.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.987 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.572 ' CD2' ' HG3' ' A' ' 9' ' ' PRO . 18.7 p90 -145.7 152.66 39.95 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.317 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -84.73 139.41 32.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 29' ' ' LEU . 35.7 t-20 -112.4 88.06 2.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.345 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.71 -25.47 18.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.227 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -79.75 -4.77 53.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.616 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.3 1.1 1.76 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.73 -6.35 2.79 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 114.826 0.69 . . . . 0.0 114.826 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.444 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 2.3 mp -122.33 174.22 7.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.395 0.597 . . . . 0.0 111.341 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 22' ' ' PHE . 1.9 m -102.81 168.02 9.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.076 0.465 . . . . 0.0 110.936 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 72.5 mt-30 -148.39 156.87 43.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.609 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -79.75 147.8 31.73 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.864 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.455 ' CD2' ' HB2' ' A' ' 20' ' ' ARG . 42.0 m-85 -65.49 117.01 7.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.016 0.436 . . . . 0.0 111.373 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.71 -171.93 1.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.055 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -44.42 134.08 5.31 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.782 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 39.01 26.02 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 114.842 0.697 . . . . 0.0 114.842 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.438 ' HB3' ' HB3' ' A' ' 33' ' ' PHE . . . -69.36 168.39 14.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 117.207 0.503 . . . . 0.0 110.466 179.121 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 21.1 m -155.64 145.63 21.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 111.911 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.418 ' HB1' ' HB2' ' A' ' 44' ' ' ASN . . . -70.09 174.84 4.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 41' ' ' LYS . . . -124.08 34.01 5.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.894 0.378 . . . . 0.0 111.387 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . 0.486 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER 91.19 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.487 179.149 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.473 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER -88.03 -40.22 14.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.82 -178.867 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.26 72.4 2.32 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.129 0.49 . . . . 0.0 110.521 -177.642 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.418 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 16.0 t30 -156.0 93.51 1.45 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.821 -179.18 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.594 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 99.5 m-85 -105.54 130.2 53.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -63.02 -12.98 29.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.293 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -150.35 145.47 26.14 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.951 0.405 . . . . 0.0 111.391 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.711 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . . . -60.26 -34.58 73.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.596 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 0.7 OUTLIER -60.13 -39.2 85.45 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.027 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -65.13 -47.61 76.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.438 178.661 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.422 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 3.0 t -60.81 -52.95 62.89 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.366 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.4 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 95.5 mt -56.31 -45.12 80.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.485 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -59.23 -45.38 91.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.77 0.319 . . . . 0.0 111.097 -179.616 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.4 m -81.05 -62.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -85.49 -29.44 24.27 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.4 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.517 0.179 0 C-N-CA 120.164 -1.017 . . . . 0.0 112.386 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 7.6 ptp180 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.373 0.13 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 20.8 Cg_exo -60.91 136.53 66.47 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.991 1.794 . . . . 0.0 111.717 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.11 -56.65 8.45 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -52.05 -23.6 5.48 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.635 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 70.7 m -62.05 -17.48 57.54 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.978 0.418 . . . . 0.0 110.647 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.1 mt -82.93 -14.53 53.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.231 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.63 119.23 74.02 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.195 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -85.98 156.73 10.01 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.656 2.237 . . . . 0.0 112.258 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.405 ' HG3' ' CD2' ' A' ' 22' ' ' PHE . 91.2 Cg_endo -88.63 -177.84 1.82 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.695 2.264 . . . . 0.0 112.029 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 27.4 p90 -152.94 152.07 31.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.914 0.388 . . . . 0.0 111.115 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -125.48 124.07 40.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.337 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -178.45 89.08 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.189 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.49 94.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.852 0.358 . . . . 0.0 111.186 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.2 m . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.591 179.83 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.615 0.245 . . . . 0.0 111.526 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -137.47 166.42 23.91 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.434 178.915 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -136.07 165.48 25.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 111.755 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.488 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 12.5 p90 -144.53 153.08 41.46 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.56 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.635 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 82.9 t80 -84.43 139.71 32.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.158 0.504 . . . . 0.0 111.707 -178.772 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -115.62 90.15 3.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.024 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.42 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . . . -52.74 -28.53 22.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.8 0.333 . . . . 0.0 111.356 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -1.84 37.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.611 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.69 -3.07 1.5 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.98 -3.73 3.78 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.57 172.8 9.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.231 0.516 . . . . 0.0 111.39 -179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 2.0 m -100.41 170.11 8.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.074 0.464 . . . . 0.0 111.485 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -147.99 151.51 35.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.444 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.528 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 1.5 t -74.22 147.18 42.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.429 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -74.72 131.15 40.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.559 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.52 157.68 37.15 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.64 64.13 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.205 0.526 . . . . 0.0 110.822 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 168.77 -27.95 0.14 Allowed Glycine 0 N--CA 1.429 -1.805 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.362 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -63.35 129.99 42.6 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.932 0.396 . . . . 0.0 111.656 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 13.6 m -83.5 149.62 26.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.976 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.65 164.01 24.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.781 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -112.72 168.15 9.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.113 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -63.78 -75.35 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.593 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 -86.26 -31.9 21.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.484 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.45 ' O ' ' HB3' ' A' ' 44' ' ' ASN . 0.5 OUTLIER -73.79 -177.01 2.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.13 0.49 . . . . 0.0 109.955 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 43' ' ' ASN . 56.5 t-20 74.0 115.65 0.06 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.62 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.447 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 64.2 m-85 -119.41 144.48 46.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.756 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -16.3 59.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.621 0.248 . . . . 0.0 111.434 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.85 146.21 25.51 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 111.32 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.77 81.03 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.092 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 2.0 tt0 -58.68 -39.86 81.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.447 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.56 -43.22 90.52 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.398 178.473 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.404 ' O ' ' N ' ' A' ' 55' ' ' CYS . 3.6 t -62.22 -58.19 8.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.16 0.505 . . . . 0.0 109.867 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.76 -44.97 70.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.846 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -59.36 -50.39 74.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.735 0.303 . . . . 0.0 111.206 -179.376 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -78.29 -61.25 2.07 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.433 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.8 OUTLIER -74.54 -41.37 60.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.218 0 C-N-CA 120.396 -0.907 . . . . 0.0 112.445 -179.658 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.453 ' NE ' HD21 ' A' ' 6' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.556 0.217 . . . . 0.0 111.12 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -52.97 132.77 48.98 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.055 1.837 . . . . 0.0 111.768 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -47.74 -51.92 20.42 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.413 ' CB ' ' HG3' ' A' ' 42' ' ' ARG . 2.8 p90 -52.23 -22.32 4.27 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.837 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.524 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.6 m -57.78 -20.29 34.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.167 0.508 . . . . 0.0 110.428 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.453 HD21 ' NE ' ' A' ' 1' ' ' ARG . 36.5 mt -82.21 -17.55 45.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.145 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 28.7 tp10 -75.45 111.43 14.09 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.454 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 36.9 Cg_endo -94.18 158.71 2.12 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 122.955 2.436 . . . . 0.0 112.292 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.94 -162.74 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.627 2.218 . . . . 0.0 112.095 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 18.6 p90 -150.21 144.92 25.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -110.55 115.14 29.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.848 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.37 138.62 3.05 Favored Glycine 0 C--N 1.328 0.111 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.211 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.38 45.4 8.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.046 0.451 . . . . 0.0 110.392 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.73 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.041 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.779 0.323 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.72 -177.79 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.22 0.533 . . . . 0.0 111.068 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -131.97 166.87 20.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.972 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -143.27 152.57 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.468 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.524 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 78.4 t80 -86.74 143.46 27.54 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.994 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASN . . . . . 0.416 ' HB3' ' HB3' ' A' ' 27' ' ' ALA . 51.9 t-20 -115.01 102.07 9.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.621 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.8 -27.0 59.2 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.31 -13.63 43.08 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.416 ' HB3' ' HB3' ' A' ' 24' ' ' ASN . . . -115.04 -14.03 11.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.62 0.248 . . . . 0.0 111.664 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.68 -6.44 25.1 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 121.066 -0.587 . . . . 0.0 113.721 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 mp -127.69 176.61 7.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 0.0 110.796 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 m -101.61 168.17 9.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.256 0.551 . . . . 0.0 111.204 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -152.17 145.13 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.311 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.52 145.84 32.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.583 ' CE2' ' HA ' ' A' ' 39' ' ' ALA . 78.7 m-85 -58.61 134.47 56.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.446 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -164.68 171.89 13.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.793 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.1 t80 54.71 62.54 2.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.345 0.593 . . . . 0.0 110.394 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.73 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . 52.4 5.82 0.23 Allowed Glycine 0 N--CA 1.436 -1.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 114.407 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.81 126.12 26.96 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.076 0.938 . . . . 0.0 111.122 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -85.49 174.51 9.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.511 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.583 ' HA ' ' CE2' ' A' ' 33' ' ' PHE . . . -72.3 129.49 38.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.597 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.0 165.45 24.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.435 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -62.5 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.196 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.413 ' HG3' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -93.77 -24.72 17.69 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.13 79.3 2.27 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.95 0.405 . . . . 0.0 110.377 -178.349 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -155.52 105.48 2.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.514 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.565 ' HE1' HG21 ' A' ' 54' ' ' THR . 86.8 m-85 -103.47 140.53 37.37 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.02 -15.3 30.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.783 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -165.85 154.33 11.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.896 0.379 . . . . 0.0 111.08 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.16 -38.08 75.93 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -60.32 -36.71 78.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -49.11 65.63 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.562 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 19.0 t -62.27 -55.63 26.45 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.891 0.377 . . . . 0.0 110.558 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.52 ' HA ' ' HA3' ' A' ' 56' ' ' GLY . 79.5 mt -51.77 -52.59 47.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.85 -35.28 70.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.816 0.341 . . . . 0.0 110.77 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.565 HG21 ' HE1' ' A' ' 45' ' ' PHE . 23.0 m -80.07 -70.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.798 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.1 t -96.89 -23.07 16.52 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLY . . . . . 0.52 ' HA3' ' HA ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.926 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.415 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 16.6 Cg_exo -61.91 135.16 53.95 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.021 1.814 . . . . 0.0 111.888 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.19 -58.46 4.5 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . 0.511 ' HB3' ' HB3' ' A' ' 42' ' ' ARG . 8.2 p90 -49.93 -25.07 2.91 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.649 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.1 m -60.88 -26.18 67.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.123 0.487 . . . . 0.0 110.523 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 mt -83.63 -13.22 54.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.92 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.49 114.89 33.93 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.413 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -93.79 153.71 2.3 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.01 2.474 . . . . 0.0 112.089 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -78.13 147.26 23.39 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.398 2.065 . . . . 0.0 112.255 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.526 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 10.4 p90 -84.69 130.01 34.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -97.86 88.06 4.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 154.01 152.71 6.16 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.572 -0.823 . . . . 0.0 112.498 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 58.96 37.48 24.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.914 0.388 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 48.0 t . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.383 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.117 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.456 ' HB2' ' CD1' ' A' ' 33' ' ' PHE . 6.6 mtp85 -142.38 158.42 43.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 111.038 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.591 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 3.1 m-85 -140.91 172.33 12.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.211 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -150.6 156.28 41.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.113 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.649 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -83.42 138.27 33.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.072 0.463 . . . . 0.0 110.965 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -105.4 91.39 3.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.319 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.57 -22.81 9.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.61 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.19 -1.6 57.68 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.59 -3.6 1.87 Allowed 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . 0.413 ' HA2' ' OH ' ' A' ' 23' ' ' TYR . . . 70.44 -7.73 4.65 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 114.882 0.713 . . . . 0.0 114.882 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.1 mp -123.52 171.37 9.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.488 0.644 . . . . 0.0 111.674 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.4 m -101.68 164.27 11.83 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-O 121.386 0.612 . . . . 0.0 111.196 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -149.72 160.92 43.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.97 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 t -75.11 156.56 35.89 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.646 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.456 ' CD1' ' HB2' ' A' ' 20' ' ' ARG . 76.5 m-85 -72.89 98.68 2.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.255 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.452 ' O ' ' O ' ' A' ' 35' ' ' TYR . . . -77.08 164.0 26.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.708 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.847 ' CE1' ' HB2' ' A' ' 37' ' ' ALA . 19.9 p90 41.56 -169.9 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.538 0.685 . . . . 0.0 111.299 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . -65.06 28.38 0.11 Allowed Glycine 0 C--N 1.311 -0.819 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.12 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.847 ' HB2' ' CE1' ' A' ' 35' ' ' TYR . . . -67.15 128.3 35.87 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 118.449 1.124 . . . . 0.0 110.83 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.526 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 0.3 OUTLIER -84.17 165.01 18.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.056 0.455 . . . . 0.0 111.468 -179.86 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.98 136.72 46.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.412 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.861 ' HB3' ' O ' ' A' ' 43' ' ' ASN . . . -69.37 152.93 44.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.865 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.28 -65.45 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.511 ' HB3' ' HB3' ' A' ' 4' ' ' PHE . 5.3 mtp180 -88.8 -54.05 4.33 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASN . . . . . 0.861 ' O ' ' HB3' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -84.6 96.94 9.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.571 0.7 . . . . 0.0 111.049 -178.924 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -156.81 95.49 1.53 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.668 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.522 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 85.0 m-85 -103.76 128.6 51.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.78 0.324 . . . . 0.0 110.911 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mttt -63.43 -13.49 40.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.923 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.32 142.41 33.84 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.017 0.437 . . . . 0.0 111.127 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.591 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -61.98 -38.17 87.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.336 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -58.99 -38.62 79.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.522 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -65.65 -44.05 87.54 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.201 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 55' ' ' CYS . 2.0 t -61.43 -55.34 32.48 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 88.7 mt -53.26 -42.93 66.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.293 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.51 79.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.864 0.364 . . . . 0.0 110.515 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.445 ' HG1' ' HE2' ' A' ' 45' ' ' PHE . 8.0 m -80.13 -62.89 1.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.835 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.451 ' N ' ' O ' ' A' ' 51' ' ' CYS . 1.5 m -72.12 -44.69 62.78 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.235 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.681 -179.33 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' ARG . . . . . 0.63 ' NH2' ' HB1' ' A' ' 25' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.664 0.269 . . . . 0.0 111.247 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 2' ' ' PRO . . . . . 0.479 ' HG2' ' HA ' ' A' ' 55' ' ' CYS . 25.5 Cg_exo -58.14 152.09 54.63 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.239 1.959 . . . . 0.0 112.041 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -49.03 -61.31 2.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.673 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -55.12 -22.98 18.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.71 0.291 . . . . 0.0 111.245 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' CYS . . . . . 0.453 ' SG ' ' CD2' ' A' ' 23' ' ' TYR . 0.1 OUTLIER -60.46 -20.05 58.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.149 0.5 . . . . 0.0 109.964 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.5 HD23 ' HE ' ' A' ' 1' ' ' ARG . 16.5 mt -82.13 -17.06 47.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.409 178.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.35 114.21 27.66 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.007 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -85.37 156.71 10.88 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.572 2.182 . . . . 0.0 112.248 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PRO . . . . . 0.53 ' HG3' ' CD1' ' A' ' 22' ' ' PHE . 62.7 Cg_endo -85.87 176.15 5.49 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.636 2.224 . . . . 0.0 111.408 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TYR . . . . . 0.457 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 1.1 p90 -155.74 149.73 25.45 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 111.771 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -117.62 107.79 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.46 -115.32 0.95 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.256 -0.973 . . . . 0.0 113.719 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.411 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -75.55 77.75 2.57 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -178.337 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 13' ' ' ALA . 88.0 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.031 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.549 0.214 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -142.85 167.87 21.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.463 0.649 . . . . 0.0 111.216 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.4 ' CZ ' HG23 ' A' ' 32' ' ' THR . 61.6 m-85 -139.65 167.14 22.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.156 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PHE . . . . . 0.53 ' CD1' ' HG3' ' A' ' 9' ' ' PRO . 13.6 p90 -149.14 146.65 27.78 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.477 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CD2' ' SG ' ' A' ' 5' ' ' CYS . 83.5 t80 -83.93 132.07 34.8 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.922 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -102.23 98.1 8.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.502 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.63 ' HB1' ' NH2' ' A' ' 1' ' ' ARG . . . -53.57 -33.12 53.63 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.385 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -83.23 3.35 31.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.953 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.53 -4.76 1.81 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.28 -6.62 2.22 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.886 0.715 . . . . 0.0 114.886 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.45 171.55 11.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.524 0.662 . . . . 0.0 111.225 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.513 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 1.6 m -96.35 168.39 10.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.114 0.483 . . . . 0.0 111.197 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 4.0 tt0 -147.62 152.71 38.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.737 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' THR . . . . . 0.4 HG23 ' CZ ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -76.62 134.46 39.32 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.821 179.078 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -61.01 166.63 3.39 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.684 ' H ' ' HB3' ' A' ' 37' ' ' ALA . . . -168.52 -152.32 0.11 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.801 -179.165 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.423 ' C ' ' H ' ' A' ' 37' ' ' ALA . 12.9 t80 -39.51 121.69 1.24 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 11' ' ' ALA . . . 54.17 -2.92 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.167 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ALA . . . . . 0.684 ' HB3' ' H ' ' A' ' 34' ' ' ALA . . . -67.44 106.82 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.967 0.883 . . . . 0.0 110.881 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' CYS . . . . . 0.457 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 70.8 m -82.82 145.23 29.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.45 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 138.69 49.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.226 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -87.84 164.4 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.794 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -71.73 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.651 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -86.12 -38.74 17.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.068 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.62 70.04 2.4 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 121.229 0.538 . . . . 0.0 110.306 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -155.77 92.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.165 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.547 ' CG ' ' HA ' ' A' ' 51' ' ' CYS . 81.2 m-85 -106.29 134.47 49.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 110.662 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -13.75 25.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.021 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.66 150.84 26.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 0.0 111.095 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.37 -38.98 78.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -37.88 81.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . 0.506 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.22 -42.98 83.14 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.288 178.597 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.547 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 5.3 t -63.83 -59.76 4.13 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 121.159 0.504 . . . . 0.0 109.815 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -52.64 -42.28 64.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.436 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -59.16 -51.69 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.825 0.345 . . . . 0.0 111.181 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.404 ' HB ' ' CE1' ' A' ' 45' ' ' PHE . 2.0 m -79.96 -59.92 2.54 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.467 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' CYS . . . . . 0.479 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -69.63 -47.77 62.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.866 -178.846 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.268 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.582 -179.36 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.577 0.227 . . . . 0.0 111.035 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.563 ' HG2' HG22 ' A' ' 54' ' ' THR . 37.9 Cg_exo -58.09 136.42 74.81 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.405 2.07 . . . . 0.0 112.368 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.56 -60.02 2.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.449 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 27.3 p90 -51.66 -29.83 19.45 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 2' ' ' PRO . 66.9 m -59.46 -21.03 59.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.012 0.434 . . . . 0.0 110.699 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.4 mt -81.86 -11.39 58.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.225 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.449 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 6.8 mt-10 -72.24 114.88 33.34 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.539 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.9 158.19 7.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 111.896 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.461 ' HG3' ' CZ ' ' A' ' 22' ' ' PHE . 95.0 Cg_endo -77.12 143.08 22.32 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.318 2.012 . . . . 0.0 112.371 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.532 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 27.8 p90 -87.94 130.63 34.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.912 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.24 94.0 6.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.265 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -118.61 -95.73 1.71 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.323 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -161.89 97.96 1.06 Allowed 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 120.849 0.357 . . . . 0.0 111.44 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 p -165.37 130.14 2.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.782 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -80.74 127.45 32.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.585 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -166.44 147.43 6.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.014 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -161.54 44.34 0.16 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.18 0.514 . . . . 0.0 111.062 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.81 161.83 30.36 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.873 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.48 45.26 0.66 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.395 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -102.02 164.01 11.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.129 0.49 . . . . 0.0 111.237 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.82 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 48.6 m-85 -136.84 156.69 48.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.965 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.552 ' HB2' ' OD1' ' A' ' 43' ' ' ASN . 8.3 p90 -144.42 159.9 41.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.56 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -86.74 145.15 26.76 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.692 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 29' ' ' LEU . 37.0 t-20 -114.26 87.95 2.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.648 178.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.23 -23.84 6.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.673 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.68 -0.96 57.8 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.43 -1.94 1.28 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 -3.29 4.28 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 121.04 -0.6 . . . . 0.0 114.515 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -118.76 171.93 7.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.088 0.444 . . . . 0.0 111.016 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 11.7 m -100.86 177.66 4.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.256 0.55 . . . . 0.0 111.267 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 2.7 tp60 -149.39 138.7 21.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.358 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 5.2 t -83.23 31.8 0.45 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.38 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.444 ' CE1' ' HA ' ' A' ' 39' ' ' ALA . 90.4 m-85 65.48 159.63 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.393 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -167.12 172.71 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.624 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 43.75 -165.6 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.439 0.637 . . . . 0.0 110.7 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.29 22.11 0.82 Allowed Glycine 0 C--N 1.311 -0.835 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.818 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.61 130.92 44.99 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 117.402 0.601 . . . . 0.0 110.956 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.532 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 1.2 m -84.21 153.76 23.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.159 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.444 ' HA ' ' CE1' ' A' ' 33' ' ' PHE . . . -69.42 132.48 46.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.949 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 43' ' ' ASN . . . -80.82 151.12 28.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.219 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -65.42 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.973 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.444 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 10.1 mmp_? -85.46 -42.25 14.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.45 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.552 ' OD1' ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.93 69.61 1.9 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.161 0.505 . . . . 0.0 110.408 -177.858 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.3 p-10 -156.44 105.71 2.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.261 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.506 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 83.3 m-85 -108.77 143.09 38.37 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.817 0.341 . . . . 0.0 110.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -63.39 -16.59 60.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.472 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -154.54 147.88 24.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.901 0.381 . . . . 0.0 111.164 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.82 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -59.44 -37.43 78.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.81 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 55.1 tt0 -60.54 -38.69 85.3 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.506 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -64.63 -45.31 87.4 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.203 178.434 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 5.1 t -61.01 -54.82 40.2 Favored 'General case' 0 C--N 1.339 0.114 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.446 HD23 ' SG ' ' A' ' 30' ' ' CYS . 95.3 mt -56.39 -38.23 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.381 179.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 8.2 ttp180 -60.55 -53.85 52.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.831 0.348 . . . . 0.0 111.013 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.563 HG22 ' HG2' ' A' ' 2' ' ' PRO . 18.9 m -79.31 -56.2 4.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.841 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.7 m -76.52 -41.46 46.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.437 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -83.84 -152.24 13.62 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.121 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 137.59 -54.51 0.7 Allowed Glycine 0 C--N 1.329 0.174 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.5 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.093 -179.881 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.0 ttm105 . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.61 0.243 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 4' ' ' PHE . 13.4 Cg_exo -63.39 131.03 30.35 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.125 1.883 . . . . 0.0 111.818 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -50.44 -51.62 45.11 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.442 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 6.4 p90 -51.39 -24.09 4.47 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 66.2 m -60.0 -19.96 55.26 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.134 0.493 . . . . 0.0 110.683 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.25 -11.54 57.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.442 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 59.0 mt-10 -72.0 119.84 76.75 Favored Pre-proline 0 N--CA 1.461 0.124 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.105 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -88.46 151.63 6.49 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 122.687 2.258 . . . . 0.0 112.033 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.435 ' HG3' ' CE2' ' A' ' 22' ' ' PHE . 73.8 Cg_endo -74.97 -172.14 1.17 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.316 2.011 . . . . 0.0 112.291 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 1.1 p90 -152.45 156.8 40.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -103.97 75.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.34 -164.59 40.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.535 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 77.72 6.89 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.64 0.257 . . . . 0.0 111.557 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.3 m -158.0 116.38 3.09 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.953 0.406 . . . . 0.0 110.399 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.0 mtp85 -86.62 23.31 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.125 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.18 141.8 41.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.734 0.302 . . . . 0.0 110.969 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -160.49 41.06 0.17 Allowed 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.296 0.569 . . . . 0.0 111.273 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -175.79 80.36 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.468 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -163.4 -55.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mmm-85 -140.02 -177.03 4.81 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 111.965 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.558 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 10.0 m-85 -130.47 175.47 8.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.016 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.435 ' CE2' ' HG3' ' A' ' 9' ' ' PRO . 19.7 p90 -146.9 150.25 34.85 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.297 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.473 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 84.1 t80 -85.98 134.07 33.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.6 t-20 -104.69 92.28 4.21 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.79 -28.01 32.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.353 . . . . 0.0 111.291 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -1.14 47.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.94 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.48 -2.93 1.55 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.6 -4.35 4.08 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 114.532 0.573 . . . . 0.0 114.532 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -124.37 169.63 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.161 0.481 . . . . 0.0 111.418 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m -101.6 166.0 10.93 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.947 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.429 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -149.57 151.49 33.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.866 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -78.0 137.71 38.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.105 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 38' ' ' CYS . 84.0 m-85 -46.39 106.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.089 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.496 ' O ' ' HB3' ' A' ' 37' ' ' ALA . . . -74.3 -176.11 2.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.912 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.461 ' C ' ' H ' ' A' ' 37' ' ' ALA . 21.7 p90 -43.72 139.42 2.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.315 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.34 -8.35 0.04 OUTLIER Glycine 0 N--CA 1.438 -1.199 0 N-CA-C 114.65 0.62 . . . . 0.0 114.65 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 34' ' ' ALA . . . -71.7 105.19 3.62 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 117.597 0.698 . . . . 0.0 111.453 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -88.11 171.92 9.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.778 0.323 . . . . 0.0 111.036 179.517 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.44 141.26 50.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.82 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.99 174.63 6.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.062 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -62.9 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.607 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.5 mmm-85 -89.99 -34.49 15.97 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.57 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.62 79.11 2.0 Allowed 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.969 0.414 . . . . 0.0 110.972 -177.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -157.45 97.54 1.62 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.568 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 97.9 m-85 -105.08 140.4 38.31 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.3 -18.11 47.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.851 -178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.79 151.2 21.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 0.0 111.04 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.558 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -57.54 -38.28 74.46 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -61.38 -38.31 86.54 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.513 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.46 -45.29 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.969 178.252 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 1.4 t -60.66 -55.38 33.91 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.927 0.394 . . . . 0.0 110.119 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.431 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 71.6 mt -53.3 -43.22 67.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.367 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -52.36 65.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.761 0.315 . . . . 0.0 111.207 -179.595 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.9 m -79.16 -57.32 3.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -82.79 -37.21 24.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.431 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -70.06 148.72 46.55 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.437 -0.887 . . . . 0.0 112.744 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -165.73 29.82 0.2 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.379 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.071 179.938 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.409 ' HG3' HD21 ' A' ' 6' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.615 0.245 . . . . 0.0 111.195 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.414 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.9 Cg_exo -63.42 136.23 53.88 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.318 2.012 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -44.29 -61.71 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.415 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 33.4 p90 -51.05 -30.2 14.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 73.6 m -60.79 -20.24 61.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.106 0.479 . . . . 0.0 110.629 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.409 HD21 ' HG3' ' A' ' 1' ' ' ARG . 13.0 mt -80.25 -13.56 59.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.133 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.415 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 32.8 mt-10 -71.86 114.85 32.32 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.014 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 87.2 Cg_endo -85.0 152.08 11.06 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.46 2.107 . . . . 0.0 112.43 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 14.6 Cg_endo -90.34 -169.11 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.052 2.501 . . . . 0.0 111.671 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.498 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 39.9 p90 -152.33 133.24 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.884 0.373 . . . . 0.0 111.367 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -110.32 111.06 22.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.272 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -160.54 -109.88 0.26 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.49 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.16 78.32 6.83 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.0 m -156.47 175.08 14.49 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.323 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -154.48 88.41 1.21 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.006 -179.704 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -164.72 142.9 6.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.017 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -159.16 47.05 0.3 Allowed 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.744 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.66 -176.5 1.63 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.943 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.1 63.33 3.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.195 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.452 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 1.5 mtp180 -132.11 164.38 26.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.252 0.548 . . . . 0.0 110.869 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CD1' ' N ' ' A' ' 21' ' ' TYR . 2.4 m-85 -143.68 177.95 8.14 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.706 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 19.1 p90 -149.5 157.33 43.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.031 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.471 ' CG ' ' HB3' ' A' ' 55' ' ' CYS . 60.6 t80 -84.38 144.39 28.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.927 0.394 . . . . 0.0 111.305 -179.286 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -116.72 89.6 3.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.125 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.15 -24.49 10.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.432 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -3.87 58.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.931 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.27 -2.05 1.86 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.38 -3.26 8.32 Favored Glycine 0 N--CA 1.446 -0.664 0 N-CA-C 114.772 0.669 . . . . 0.0 114.772 178.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.22 175.74 7.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.342 0.571 . . . . 0.0 111.436 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.5 m -100.79 173.05 6.69 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.265 0.555 . . . . 0.0 111.605 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.13 151.61 34.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.996 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 t -77.42 149.06 35.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.88 0.371 . . . . 0.0 110.726 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.85 111.77 3.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.998 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.29 158.21 36.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.875 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -64.57 65.05 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.205 0.526 . . . . 0.0 111.355 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 171.68 -33.85 0.14 Allowed Glycine 0 N--CA 1.429 -1.813 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.574 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.64 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -65.77 124.15 21.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.498 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -81.93 153.81 26.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.565 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.32 118.38 11.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.244 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.64 168.02 19.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.889 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.407 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 2.7 tttp -60.97 -77.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.405 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 24.1 mmm-85 -92.86 -29.35 15.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.935 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.33 72.22 2.36 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.031 0.443 . . . . 0.0 111.03 -177.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 41' ' ' LYS . 5.0 p30 -159.5 101.71 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.496 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.6 m-85 -107.24 136.57 46.83 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.701 0.286 . . . . 0.0 110.473 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -64.36 -12.33 41.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.494 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -154.44 147.36 24.49 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.905 0.384 . . . . 0.0 111.387 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.93 81.61 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.624 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 13.6 mt-10 -58.51 -38.44 77.72 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.483 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.12 -46.48 74.03 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.412 ' O ' ' N ' ' A' ' 55' ' ' CYS . 7.7 t -63.72 -54.07 41.17 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.5 0.667 . . . . 0.0 109.591 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.413 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 19.9 mt -53.58 -42.75 67.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.641 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -61.51 -54.96 36.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 0.0 111.577 -179.537 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 m -77.76 -51.0 11.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.471 ' HB3' ' CG ' ' A' ' 23' ' ' TYR . 99.1 m -87.59 -37.11 17.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.413 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -70.76 83.63 0.38 Allowed Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.014 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.59 26.95 21.87 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.637 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.218 179.937 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.587 0.232 . . . . 0.0 111.166 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 14.8 Cg_exo -65.02 131.96 30.51 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.267 1.978 . . . . 0.0 111.959 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.13 -55.82 9.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -51.03 -27.47 7.98 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 78.1 m -59.59 -23.82 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.161 0.505 . . . . 0.0 110.378 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mt -80.98 -13.53 58.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.622 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -73.12 117.07 56.97 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.756 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.12 160.46 45.44 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.14 1.893 . . . . 0.0 111.874 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HD3' ' CD2' ' A' ' 22' ' ' PHE . 5.9 Cg_exo -41.46 170.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.936 2.424 . . . . 0.0 112.996 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD1' ' N ' ' A' ' 11' ' ' ALA . 37.3 t80 -79.67 166.59 21.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.73 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.499 ' N ' ' CD1' ' A' ' 10' ' ' TYR . . . -137.9 91.61 2.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.198 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.24 -164.06 10.28 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.67 36.0 0.69 Allowed 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.8 m -76.14 156.94 33.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.764 0.316 . . . . 0.0 110.718 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -158.66 103.96 1.76 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.848 0.356 . . . . 0.0 111.294 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 64.99 95.47 0.05 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.61 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -162.57 50.94 0.19 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.118 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.08 123.79 22.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.55 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.0 -48.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.144 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 32' ' ' THR . 4.2 mtm-85 -99.89 179.64 4.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.279 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.748 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 14.8 m-85 -135.63 168.5 19.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.468 ' CZ ' ' HB3' ' A' ' 31' ' ' GLN . 52.0 p90 -145.32 156.79 44.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.353 178.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -85.94 140.54 30.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.922 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.509 ' CG ' ' HB3' ' A' ' 27' ' ' ALA . 50.0 t-20 -107.53 89.29 2.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.009 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.84 -25.16 10.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.792 0.33 . . . . 0.0 111.309 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -92.49 1.84 57.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.094 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.509 ' HB3' ' CG ' ' A' ' 24' ' ' ASN . . . -139.69 -1.59 1.63 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 64.35 -4.45 1.37 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 0.1 OUTLIER -121.89 172.45 8.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 117.236 0.518 . . . . 0.0 111.096 -179.762 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.2 m -103.29 170.63 7.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.323 0.582 . . . . 0.0 111.194 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -151.08 143.49 24.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.186 179.74 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.433 ' N ' ' HG3' ' A' ' 31' ' ' GLN . 1.7 t -75.82 130.65 38.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.728 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 22' ' ' PHE . 64.9 m-85 -55.09 161.3 1.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.071 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.07 -159.28 0.38 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 112.029 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -36.91 140.86 0.14 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.143 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 43.99 38.44 4.66 Favored Glycine 0 N--CA 1.434 -1.444 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.229 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.63 91.61 0.76 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.102 0.477 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.429 ' N ' ' HB3' ' A' ' 10' ' ' TYR . 36.8 m -88.48 174.62 8.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.158 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.09 127.88 33.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.156 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.37 144.68 32.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.943 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -33.78 76.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.669 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -82.76 0.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.553 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.89 103.73 14.21 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.308 0.575 . . . . 0.0 111.596 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -159.15 106.99 1.81 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.883 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.501 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 88.7 m-85 -105.04 136.91 43.65 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.853 0.359 . . . . 0.0 110.866 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.63 -15.1 50.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.576 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.483 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -151.17 146.65 26.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.008 0.433 . . . . 0.0 111.235 179.931 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.748 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -59.49 -38.98 82.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.055 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -60.05 -38.48 82.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.501 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.93 -43.88 86.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.102 178.492 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER -62.25 -55.91 23.75 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.511 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.3 mt -55.04 -41.27 71.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.359 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -59.38 -51.34 70.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.828 0.347 . . . . 0.0 110.978 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.4 ' HB ' ' CZ ' ' A' ' 45' ' ' PHE . 7.0 m -80.02 -58.71 3.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.725 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 17.4 m -73.88 -43.99 56.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -64.2 154.91 46.93 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.736 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -170.88 -68.06 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.443 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.238 -0.887 . . . . 0.0 111.608 179.882 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 9.7 ptp85 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.493 0.187 . . . . 0.0 111.259 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 13.7 Cg_exo -67.77 132.45 26.78 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.437 2.091 . . . . 0.0 112.155 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -58.16 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.529 ' HB2' ' HB2' ' A' ' 42' ' ' ARG . 13.8 p90 -51.3 -26.61 7.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.089 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 78.5 m -60.08 -19.93 55.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.084 0.468 . . . . 0.0 110.409 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.404 HD21 ' HD2' ' A' ' 1' ' ' ARG . 17.9 mt -81.75 -7.09 59.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.842 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.443 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 31.7 mm-40 -71.19 118.83 69.39 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.242 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 10.0 Cg_exo -70.79 150.43 61.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.5 2.134 . . . . 0.0 112.112 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.4 Cg_endo -80.26 -176.97 3.47 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.744 2.296 . . . . 0.0 111.919 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -153.99 161.46 41.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.41 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -134.74 108.4 7.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.11 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 13' ' ' ALA . . . 172.74 143.94 4.38 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.454 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 12' ' ' GLY . . . 70.63 35.06 1.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 111.337 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.06 165.74 26.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.929 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.467 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.4 tmt_? -159.27 106.06 1.74 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 15' ' ' ARG . . . 71.69 101.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.074 178.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -163.02 44.92 0.13 Allowed 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.37 0.605 . . . . 0.0 110.467 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.52 88.98 0.94 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.896 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.64 21.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.23 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -146.13 168.0 22.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.595 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -137.23 173.15 11.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.914 0.388 . . . . 0.0 111.117 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.507 ' CE1' ' HB2' ' A' ' 31' ' ' GLN . 25.7 p90 -147.29 155.13 41.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.473 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -86.57 140.0 30.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -115.48 90.28 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.18 -29.67 33.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -79.05 -2.02 38.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.473 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.65 -1.84 2.01 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.77 -8.6 1.68 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 121.053 -0.594 . . . . 0.0 114.542 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.69 176.86 6.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 117.34 0.57 . . . . 0.0 111.253 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.1 m -97.34 171.43 8.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.335 0.588 . . . . 0.0 111.315 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.507 ' HB2' ' CE1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -146.54 142.46 28.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.601 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 t -75.43 137.9 41.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 110.624 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.467 ' HB3' ' HB3' ' A' ' 37' ' ' ALA . 47.3 m-85 -53.9 124.1 14.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.514 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.97 -171.45 1.34 Allowed 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.067 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -51.36 142.6 13.08 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.878 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 44.8 17.13 0.08 OUTLIER Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 115.556 -0.747 . . . . 0.0 114.92 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.467 ' HB3' ' HB3' ' A' ' 33' ' ' PHE . . . -69.74 -178.97 1.63 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 117.746 0.773 . . . . 0.0 110.321 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.433 ' O ' ' CE1' ' A' ' 33' ' ' PHE . 0.9 OUTLIER -155.17 152.07 28.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.124 0.487 . . . . 0.0 111.41 179.713 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.34 139.84 50.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.236 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -92.99 -174.32 3.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.088 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -80.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.691 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.529 ' HB2' ' HB2' ' A' ' 4' ' ' PHE . 8.4 mmt-85 -87.91 -33.77 18.38 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.21 71.84 2.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.12 0.486 . . . . 0.0 110.447 -178.31 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -156.02 92.99 1.4 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.668 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.523 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.3 m-85 -107.01 131.02 54.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -12.03 18.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.795 -179.057 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.73 148.95 24.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.921 0.391 . . . . 0.0 111.276 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.11 74.88 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -38.57 84.93 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.523 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -66.57 -46.41 76.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.286 178.594 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.444 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 2.4 t -60.58 -55.58 31.65 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-O 121.028 0.442 . . . . 0.0 110.144 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.407 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 47.7 mt -53.23 -42.54 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.553 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -59.7 -51.78 68.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.829 0.347 . . . . 0.0 111.147 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.0 m -78.66 -58.57 3.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.088 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 23.2 m -76.72 -41.15 46.25 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.407 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -69.0 -77.62 0.38 Allowed Glycine 0 CA--C 1.518 0.24 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.485 -179.564 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -49.64 126.82 21.78 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.544 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.112 179.952 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.616 0.246 . . . . 0.0 111.15 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.98 138.81 81.16 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.287 1.991 . . . . 0.0 112.091 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -61.96 1.41 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.403 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.473 ' HB2' ' CB ' ' A' ' 42' ' ' ARG . 20.4 p90 -51.99 -29.83 22.46 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.6 m -61.65 -18.15 58.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.088 0.47 . . . . 0.0 110.743 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.44 -12.11 59.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.968 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -72.42 114.39 29.32 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.964 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 93.7 Cg_endo -82.45 149.57 14.83 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.429 2.086 . . . . 0.0 112.192 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.572 ' HG3' ' CD2' ' A' ' 22' ' ' PHE . 72.9 Cg_endo -94.17 144.78 1.81 Allowed 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.034 2.489 . . . . 0.0 112.556 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -87.84 142.37 27.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.666 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.36 108.36 14.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.145 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.61 143.3 6.11 Favored Glycine 0 C--N 1.33 0.203 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.554 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.91 49.26 4.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 0.0 111.111 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.7 t -165.16 165.54 19.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.126 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -160.44 81.53 0.68 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.86 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' A' ' 17' ' ' ALA . . . -166.49 149.91 7.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.892 0.377 . . . . 0.0 111.569 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' A' ' 16' ' ' ALA . . . 71.04 62.83 0.17 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.182 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.76 159.32 34.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.301 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 32.42 73.41 0.06 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.046 -0.525 . . . . 0.0 112.353 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.455 ' HB2' ' CD2' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -142.96 179.07 7.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.95 0.405 . . . . 0.0 110.918 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.711 ' CE2' ' HB2' ' A' ' 48' ' ' ALA . 46.2 m-85 -128.97 155.15 45.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.987 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.572 ' CD2' ' HG3' ' A' ' 9' ' ' PRO . 18.7 p90 -145.7 152.66 39.95 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.317 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -84.73 139.41 32.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 29' ' ' LEU . 35.7 t-20 -112.4 88.06 2.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.345 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.71 -25.47 18.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.227 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -79.75 -4.77 53.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.616 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.3 1.1 1.76 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.73 -6.35 2.79 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 114.826 0.69 . . . . 0.0 114.826 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.444 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 2.3 mp -122.33 174.22 7.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.395 0.597 . . . . 0.0 111.341 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 22' ' ' PHE . 1.9 m -102.81 168.02 9.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.076 0.465 . . . . 0.0 110.936 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 72.5 mt-30 -148.39 156.87 43.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.609 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -79.75 147.8 31.73 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.864 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.455 ' CD2' ' HB2' ' A' ' 20' ' ' ARG . 42.0 m-85 -65.49 117.01 7.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.016 0.436 . . . . 0.0 111.373 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.71 -171.93 1.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.055 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -44.42 134.08 5.31 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.782 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 39.01 26.02 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 114.842 0.697 . . . . 0.0 114.842 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.438 ' HB3' ' HB3' ' A' ' 33' ' ' PHE . . . -69.36 168.39 14.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 117.207 0.503 . . . . 0.0 110.466 179.121 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 21.1 m -155.64 145.63 21.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 111.911 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.418 ' HB1' ' HB2' ' A' ' 44' ' ' ASN . . . -70.09 174.84 4.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 41' ' ' LYS . . . -124.08 34.01 5.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.894 0.378 . . . . 0.0 111.387 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . 0.486 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER 91.19 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.487 179.149 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.473 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER -88.03 -40.22 14.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.82 -178.867 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.26 72.4 2.32 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.129 0.49 . . . . 0.0 110.521 -177.642 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.418 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 16.0 t30 -156.0 93.51 1.45 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.821 -179.18 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.594 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 99.5 m-85 -105.54 130.2 53.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -63.02 -12.98 29.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.293 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -150.35 145.47 26.14 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.951 0.405 . . . . 0.0 111.391 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.711 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . . . -60.26 -34.58 73.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.596 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 0.7 OUTLIER -60.13 -39.2 85.45 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.027 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -65.13 -47.61 76.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.438 178.661 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.422 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 3.0 t -60.81 -52.95 62.89 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.366 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.4 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 95.5 mt -56.31 -45.12 80.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.485 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -59.23 -45.38 91.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.77 0.319 . . . . 0.0 111.097 -179.616 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.4 m -81.05 -62.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -85.49 -29.44 24.27 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.4 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -64.86 -124.38 0.01 OUTLIER Glycine 0 CA--C 1.517 0.179 0 C-N-CA 120.164 -1.017 . . . . 0.0 112.386 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.23 -59.39 4.86 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.336 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.995 179.78 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 7.6 ptp180 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.373 0.13 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 20.8 Cg_exo -60.91 136.53 66.47 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.991 1.794 . . . . 0.0 111.717 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.11 -56.65 8.45 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -52.05 -23.6 5.48 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.635 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 70.7 m -62.05 -17.48 57.54 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.978 0.418 . . . . 0.0 110.647 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.1 mt -82.93 -14.53 53.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.231 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.63 119.23 74.02 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.195 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -85.98 156.73 10.01 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.656 2.237 . . . . 0.0 112.258 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.405 ' HG3' ' CD2' ' A' ' 22' ' ' PHE . 91.2 Cg_endo -88.63 -177.84 1.82 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.695 2.264 . . . . 0.0 112.029 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 27.4 p90 -152.94 152.07 31.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.914 0.388 . . . . 0.0 111.115 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -125.48 124.07 40.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.337 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -178.45 89.08 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.189 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.49 94.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.852 0.358 . . . . 0.0 111.186 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.2 m -162.34 171.72 16.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.591 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.574 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -155.98 171.1 20.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.05 -179.722 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' A' ' 15' ' ' ARG . . . 80.03 90.36 0.05 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.446 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -160.85 64.9 0.3 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.958 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.89 82.85 0.65 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.208 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 56.59 92.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.526 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -137.47 166.42 23.91 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.434 178.915 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -136.07 165.48 25.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 111.755 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.488 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 12.5 p90 -144.53 153.08 41.46 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.56 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.635 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 82.9 t80 -84.43 139.71 32.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.158 0.504 . . . . 0.0 111.707 -178.772 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -115.62 90.15 3.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.024 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.42 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . . . -52.74 -28.53 22.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.8 0.333 . . . . 0.0 111.356 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -1.84 37.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.611 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.69 -3.07 1.5 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.98 -3.73 3.78 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.57 172.8 9.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.231 0.516 . . . . 0.0 111.39 -179.597 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 2.0 m -100.41 170.11 8.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.074 0.464 . . . . 0.0 111.485 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -147.99 151.51 35.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.444 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.528 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 1.5 t -74.22 147.18 42.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.429 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -74.72 131.15 40.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.559 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.52 157.68 37.15 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.64 64.13 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.205 0.526 . . . . 0.0 110.822 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 168.77 -27.95 0.14 Allowed Glycine 0 N--CA 1.429 -1.805 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.362 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -63.35 129.99 42.6 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.932 0.396 . . . . 0.0 111.656 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 13.6 m -83.5 149.62 26.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.976 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.65 164.01 24.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.781 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -112.72 168.15 9.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.113 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -63.78 -75.35 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.593 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 -86.26 -31.9 21.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.484 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.45 ' O ' ' HB3' ' A' ' 44' ' ' ASN . 0.5 OUTLIER -73.79 -177.01 2.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.13 0.49 . . . . 0.0 109.955 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 43' ' ' ASN . 56.5 t-20 74.0 115.65 0.06 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.62 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.447 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 64.2 m-85 -119.41 144.48 46.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.756 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -16.3 59.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.621 0.248 . . . . 0.0 111.434 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.85 146.21 25.51 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 111.32 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.77 81.03 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.092 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 2.0 tt0 -58.68 -39.86 81.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.447 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.56 -43.22 90.52 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.398 178.473 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.404 ' O ' ' N ' ' A' ' 55' ' ' CYS . 3.6 t -62.22 -58.19 8.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.16 0.505 . . . . 0.0 109.867 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.76 -44.97 70.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.846 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -59.36 -50.39 74.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.735 0.303 . . . . 0.0 111.206 -179.376 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -78.29 -61.25 2.07 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.433 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.8 OUTLIER -74.54 -41.37 60.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -69.35 -92.89 0.06 OUTLIER Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.396 -0.907 . . . . 0.0 112.445 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.67 90.77 0.05 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.442 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.004 179.925 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.453 ' NE ' HD21 ' A' ' 6' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.556 0.217 . . . . 0.0 111.12 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -52.97 132.77 48.98 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.055 1.837 . . . . 0.0 111.768 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -47.74 -51.92 20.42 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.413 ' CB ' ' HG3' ' A' ' 42' ' ' ARG . 2.8 p90 -52.23 -22.32 4.27 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.837 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.524 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.6 m -57.78 -20.29 34.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.167 0.508 . . . . 0.0 110.428 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.453 HD21 ' NE ' ' A' ' 1' ' ' ARG . 36.5 mt -82.21 -17.55 45.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.145 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 28.7 tp10 -75.45 111.43 14.09 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.454 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 36.9 Cg_endo -94.18 158.71 2.12 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 122.955 2.436 . . . . 0.0 112.292 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.94 -162.74 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.627 2.218 . . . . 0.0 112.095 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 18.6 p90 -150.21 144.92 25.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -110.55 115.14 29.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.848 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.37 138.62 3.05 Favored Glycine 0 C--N 1.328 0.111 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.211 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.38 45.4 8.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.046 0.451 . . . . 0.0 110.392 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.73 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 0.5 OUTLIER -161.86 177.21 10.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.041 -179.3 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -147.89 -171.69 3.88 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.009 0.433 . . . . 0.0 111.455 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.85 117.84 12.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.486 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -160.6 60.33 0.32 Allowed 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.262 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.17 137.09 57.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.293 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.21 -39.67 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.049 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.72 -177.79 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.22 0.533 . . . . 0.0 111.068 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -131.97 166.87 20.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.972 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -143.27 152.57 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.468 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.524 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 78.4 t80 -86.74 143.46 27.54 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.994 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASN . . . . . 0.416 ' HB3' ' HB3' ' A' ' 27' ' ' ALA . 51.9 t-20 -115.01 102.07 9.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.621 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.8 -27.0 59.2 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.31 -13.63 43.08 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.416 ' HB3' ' HB3' ' A' ' 24' ' ' ASN . . . -115.04 -14.03 11.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.62 0.248 . . . . 0.0 111.664 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.68 -6.44 25.1 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 121.066 -0.587 . . . . 0.0 113.721 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 mp -127.69 176.61 7.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 0.0 110.796 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 m -101.61 168.17 9.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.256 0.551 . . . . 0.0 111.204 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -152.17 145.13 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.311 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.52 145.84 32.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.583 ' CE2' ' HA ' ' A' ' 39' ' ' ALA . 78.7 m-85 -58.61 134.47 56.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.446 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -164.68 171.89 13.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.793 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.1 t80 54.71 62.54 2.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.345 0.593 . . . . 0.0 110.394 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.73 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . 52.4 5.82 0.23 Allowed Glycine 0 N--CA 1.436 -1.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 114.407 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.81 126.12 26.96 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.076 0.938 . . . . 0.0 111.122 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -85.49 174.51 9.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.511 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.583 ' HA ' ' CE2' ' A' ' 33' ' ' PHE . . . -72.3 129.49 38.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.597 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.0 165.45 24.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.435 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -62.5 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.196 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.413 ' HG3' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -93.77 -24.72 17.69 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.13 79.3 2.27 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.95 0.405 . . . . 0.0 110.377 -178.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -155.52 105.48 2.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.514 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.565 ' HE1' HG21 ' A' ' 54' ' ' THR . 86.8 m-85 -103.47 140.53 37.37 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.02 -15.3 30.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.783 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -165.85 154.33 11.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.896 0.379 . . . . 0.0 111.08 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.16 -38.08 75.93 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -60.32 -36.71 78.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -49.11 65.63 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.562 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 19.0 t -62.27 -55.63 26.45 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.891 0.377 . . . . 0.0 110.558 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.52 ' HA ' ' HA3' ' A' ' 56' ' ' GLY . 79.5 mt -51.77 -52.59 47.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.85 -35.28 70.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.816 0.341 . . . . 0.0 110.77 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.565 HG21 ' HE1' ' A' ' 45' ' ' PHE . 23.0 m -80.07 -70.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.798 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.1 t -96.89 -23.07 16.52 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLY . . . . . 0.52 ' HA3' ' HA ' ' A' ' 52' ' ' LEU . . . -47.67 98.49 0.02 OUTLIER Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.926 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -134.01 -168.56 11.83 Favored Glycine 0 N--CA 1.454 -0.137 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.286 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.246 -0.883 . . . . 0.0 111.576 -179.829 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.415 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 16.6 Cg_exo -61.91 135.16 53.95 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.021 1.814 . . . . 0.0 111.888 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.19 -58.46 4.5 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . 0.511 ' HB3' ' HB3' ' A' ' 42' ' ' ARG . 8.2 p90 -49.93 -25.07 2.91 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.649 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.1 m -60.88 -26.18 67.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.123 0.487 . . . . 0.0 110.523 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 mt -83.63 -13.22 54.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.92 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.49 114.89 33.93 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.413 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -93.79 153.71 2.3 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.01 2.474 . . . . 0.0 112.089 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -78.13 147.26 23.39 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.398 2.065 . . . . 0.0 112.255 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.526 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 10.4 p90 -84.69 130.01 34.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -97.86 88.06 4.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 154.01 152.71 6.16 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.572 -0.823 . . . . 0.0 112.498 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 58.96 37.48 24.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.914 0.388 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 48.0 t -162.99 161.52 25.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.383 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.61 134.47 8.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.893 0.378 . . . . 0.0 111.608 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.19 119.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.632 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -161.78 44.7 0.16 Allowed 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.299 0.571 . . . . 0.0 110.839 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.72 -169.25 0.15 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.749 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 47.03 25.52 0.5 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.211 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.456 ' HB2' ' CD1' ' A' ' 33' ' ' PHE . 6.6 mtp85 -142.38 158.42 43.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 111.038 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.591 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 3.1 m-85 -140.91 172.33 12.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.211 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -150.6 156.28 41.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.113 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.649 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -83.42 138.27 33.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.072 0.463 . . . . 0.0 110.965 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -105.4 91.39 3.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.319 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.57 -22.81 9.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.61 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.19 -1.6 57.68 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.59 -3.6 1.87 Allowed 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . 0.413 ' HA2' ' OH ' ' A' ' 23' ' ' TYR . . . 70.44 -7.73 4.65 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 114.882 0.713 . . . . 0.0 114.882 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.1 mp -123.52 171.37 9.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.488 0.644 . . . . 0.0 111.674 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.4 m -101.68 164.27 11.83 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-O 121.386 0.612 . . . . 0.0 111.196 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -149.72 160.92 43.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.97 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 t -75.11 156.56 35.89 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.646 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.456 ' CD1' ' HB2' ' A' ' 20' ' ' ARG . 76.5 m-85 -72.89 98.68 2.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.255 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.452 ' O ' ' O ' ' A' ' 35' ' ' TYR . . . -77.08 164.0 26.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.708 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.847 ' CE1' ' HB2' ' A' ' 37' ' ' ALA . 19.9 p90 41.56 -169.9 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.538 0.685 . . . . 0.0 111.299 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . -65.06 28.38 0.11 Allowed Glycine 0 C--N 1.311 -0.819 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.12 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.847 ' HB2' ' CE1' ' A' ' 35' ' ' TYR . . . -67.15 128.3 35.87 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 118.449 1.124 . . . . 0.0 110.83 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.526 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 0.3 OUTLIER -84.17 165.01 18.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.056 0.455 . . . . 0.0 111.468 -179.86 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.98 136.72 46.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.412 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.861 ' HB3' ' O ' ' A' ' 43' ' ' ASN . . . -69.37 152.93 44.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.865 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.28 -65.45 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.511 ' HB3' ' HB3' ' A' ' 4' ' ' PHE . 5.3 mtp180 -88.8 -54.05 4.33 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.861 ' O ' ' HB3' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -84.6 96.94 9.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.571 0.7 . . . . 0.0 111.049 -178.924 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 p-10 -156.81 95.49 1.53 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.668 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.522 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 85.0 m-85 -103.76 128.6 51.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.78 0.324 . . . . 0.0 110.911 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mttt -63.43 -13.49 40.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.923 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.32 142.41 33.84 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.017 0.437 . . . . 0.0 111.127 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.591 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -61.98 -38.17 87.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.336 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -58.99 -38.62 79.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.522 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -65.65 -44.05 87.54 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.201 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 55' ' ' CYS . 2.0 t -61.43 -55.34 32.48 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 88.7 mt -53.26 -42.93 66.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.293 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.51 79.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.864 0.364 . . . . 0.0 110.515 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.445 ' HG1' ' HE2' ' A' ' 45' ' ' PHE . 8.0 m -80.13 -62.89 1.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.835 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.451 ' N ' ' O ' ' A' ' 51' ' ' CYS . 1.5 m -72.12 -44.69 62.78 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.52 -66.33 2.91 Favored Glycine 0 CA--C 1.518 0.235 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.681 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.552 ' O ' ' HB3' ' A' ' 58' ' ' ALA . . . -62.58 -104.97 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.463 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 57' ' ' GLY . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.033 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . 0.63 ' NH2' ' HB1' ' A' ' 25' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.664 0.269 . . . . 0.0 111.247 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.479 ' HG2' ' HA ' ' A' ' 55' ' ' CYS . 25.5 Cg_exo -58.14 152.09 54.63 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.239 1.959 . . . . 0.0 112.041 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -49.03 -61.31 2.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.673 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -55.12 -22.98 18.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.71 0.291 . . . . 0.0 111.245 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' CYS . . . . . 0.453 ' SG ' ' CD2' ' A' ' 23' ' ' TYR . 0.1 OUTLIER -60.46 -20.05 58.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.149 0.5 . . . . 0.0 109.964 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.5 HD23 ' HE ' ' A' ' 1' ' ' ARG . 16.5 mt -82.13 -17.06 47.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.409 178.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.35 114.21 27.66 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.007 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -85.37 156.71 10.88 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.572 2.182 . . . . 0.0 112.248 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.53 ' HG3' ' CD1' ' A' ' 22' ' ' PHE . 62.7 Cg_endo -85.87 176.15 5.49 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.636 2.224 . . . . 0.0 111.408 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.457 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 1.1 p90 -155.74 149.73 25.45 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 111.771 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -117.62 107.79 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.46 -115.32 0.95 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.256 -0.973 . . . . 0.0 113.719 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.411 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -75.55 77.75 2.57 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -178.337 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 13' ' ' ALA . 88.0 m -159.84 179.0 9.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.031 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 -156.45 104.01 2.17 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.895 0.379 . . . . 0.0 111.525 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 63.03 130.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.532 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -161.45 45.8 0.18 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.704 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.42 ' O ' ' HB3' ' A' ' 19' ' ' ALA . . . -68.29 -174.08 0.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.206 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 18' ' ' ALA . . . 68.61 16.98 9.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.277 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -142.85 167.87 21.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.463 0.649 . . . . 0.0 111.216 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.4 ' CZ ' HG23 ' A' ' 32' ' ' THR . 61.6 m-85 -139.65 167.14 22.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.156 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PHE . . . . . 0.53 ' CD1' ' HG3' ' A' ' 9' ' ' PRO . 13.6 p90 -149.14 146.65 27.78 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.477 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CD2' ' SG ' ' A' ' 5' ' ' CYS . 83.5 t80 -83.93 132.07 34.8 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.922 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -102.23 98.1 8.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.502 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.63 ' HB1' ' NH2' ' A' ' 1' ' ' ARG . . . -53.57 -33.12 53.63 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.385 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -83.23 3.35 31.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.953 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.53 -4.76 1.81 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.28 -6.62 2.22 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.886 0.715 . . . . 0.0 114.886 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.45 171.55 11.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.524 0.662 . . . . 0.0 111.225 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.513 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 1.6 m -96.35 168.39 10.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.114 0.483 . . . . 0.0 111.197 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 4.0 tt0 -147.62 152.71 38.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.737 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.4 HG23 ' CZ ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -76.62 134.46 39.32 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.821 179.078 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -61.01 166.63 3.39 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.684 ' H ' ' HB3' ' A' ' 37' ' ' ALA . . . -168.52 -152.32 0.11 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.801 -179.165 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.423 ' C ' ' H ' ' A' ' 37' ' ' ALA . 12.9 t80 -39.51 121.69 1.24 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 11' ' ' ALA . . . 54.17 -2.92 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.167 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ALA . . . . . 0.684 ' HB3' ' H ' ' A' ' 34' ' ' ALA . . . -67.44 106.82 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.967 0.883 . . . . 0.0 110.881 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.457 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 70.8 m -82.82 145.23 29.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.45 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 138.69 49.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.226 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -87.84 164.4 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.794 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -71.73 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.651 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -86.12 -38.74 17.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.068 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.62 70.04 2.4 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 121.229 0.538 . . . . 0.0 110.306 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -155.77 92.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.165 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.547 ' CG ' ' HA ' ' A' ' 51' ' ' CYS . 81.2 m-85 -106.29 134.47 49.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 110.662 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -13.75 25.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.021 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.66 150.84 26.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 0.0 111.095 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.37 -38.98 78.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -37.88 81.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . 0.506 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.22 -42.98 83.14 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.288 178.597 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.547 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 5.3 t -63.83 -59.76 4.13 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 121.159 0.504 . . . . 0.0 109.815 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -52.64 -42.28 64.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.436 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -59.16 -51.69 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.825 0.345 . . . . 0.0 111.181 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.404 ' HB ' ' CE1' ' A' ' 45' ' ' PHE . 2.0 m -79.96 -59.92 2.54 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.467 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' CYS . . . . . 0.479 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -69.63 -47.77 62.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.866 -178.846 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 45.72 -167.84 0.04 OUTLIER Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.582 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.421 ' O ' ' HB3' ' A' ' 58' ' ' ALA . . . -175.79 -179.67 46.43 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.774 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 57' ' ' GLY . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.224 -0.894 . . . . 0.0 111.144 179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.577 0.227 . . . . 0.0 111.035 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.563 ' HG2' HG22 ' A' ' 54' ' ' THR . 37.9 Cg_exo -58.09 136.42 74.81 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.405 2.07 . . . . 0.0 112.368 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.56 -60.02 2.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.449 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 27.3 p90 -51.66 -29.83 19.45 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 2' ' ' PRO . 66.9 m -59.46 -21.03 59.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.012 0.434 . . . . 0.0 110.699 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.4 mt -81.86 -11.39 58.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.225 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.449 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 6.8 mt-10 -72.24 114.88 33.34 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.539 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.9 158.19 7.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 111.896 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.461 ' HG3' ' CZ ' ' A' ' 22' ' ' PHE . 95.0 Cg_endo -77.12 143.08 22.32 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.318 2.012 . . . . 0.0 112.371 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.532 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 27.8 p90 -87.94 130.63 34.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.912 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.24 94.0 6.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.265 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -118.61 -95.73 1.71 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.323 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -161.89 97.96 1.06 Allowed 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 120.849 0.357 . . . . 0.0 111.44 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.782 179.603 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.702 0.287 . . . . 0.0 111.395 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -102.02 164.01 11.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.129 0.49 . . . . 0.0 111.237 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.82 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 48.6 m-85 -136.84 156.69 48.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.965 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.552 ' HB2' ' OD1' ' A' ' 43' ' ' ASN . 8.3 p90 -144.42 159.9 41.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.56 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -86.74 145.15 26.76 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.692 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 29' ' ' LEU . 37.0 t-20 -114.26 87.95 2.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.648 178.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.23 -23.84 6.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.673 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.68 -0.96 57.8 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.43 -1.94 1.28 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 -3.29 4.28 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 121.04 -0.6 . . . . 0.0 114.515 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -118.76 171.93 7.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.088 0.444 . . . . 0.0 111.016 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 11.7 m -100.86 177.66 4.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.256 0.55 . . . . 0.0 111.267 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 2.7 tp60 -149.39 138.7 21.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.358 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 5.2 t -83.23 31.8 0.45 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.38 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.444 ' CE1' ' HA ' ' A' ' 39' ' ' ALA . 90.4 m-85 65.48 159.63 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.393 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -167.12 172.71 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.624 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 43.75 -165.6 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.439 0.637 . . . . 0.0 110.7 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.29 22.11 0.82 Allowed Glycine 0 C--N 1.311 -0.835 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.818 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.61 130.92 44.99 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 117.402 0.601 . . . . 0.0 110.956 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.532 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 1.2 m -84.21 153.76 23.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.159 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.444 ' HA ' ' CE1' ' A' ' 33' ' ' PHE . . . -69.42 132.48 46.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.949 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 43' ' ' ASN . . . -80.82 151.12 28.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.219 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -65.42 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.973 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.444 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 10.1 mmp_? -85.46 -42.25 14.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.45 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.552 ' OD1' ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.93 69.61 1.9 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.161 0.505 . . . . 0.0 110.408 -177.858 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.3 p-10 -156.44 105.71 2.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.261 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.506 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 83.3 m-85 -108.77 143.09 38.37 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.817 0.341 . . . . 0.0 110.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -63.39 -16.59 60.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.472 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -154.54 147.88 24.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.901 0.381 . . . . 0.0 111.164 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.82 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -59.44 -37.43 78.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.81 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 55.1 tt0 -60.54 -38.69 85.3 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.506 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -64.63 -45.31 87.4 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.203 178.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 5.1 t -61.01 -54.82 40.2 Favored 'General case' 0 C--N 1.339 0.114 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.446 HD23 ' SG ' ' A' ' 30' ' ' CYS . 95.3 mt -56.39 -38.23 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.381 179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 8.2 ttp180 -60.55 -53.85 52.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.831 0.348 . . . . 0.0 111.013 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.563 HG22 ' HG2' ' A' ' 2' ' ' PRO . 18.9 m -79.31 -56.2 4.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.841 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.7 m -76.52 -41.46 46.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.437 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.226 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.121 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.0 ttm105 . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.61 0.243 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 4' ' ' PHE . 13.4 Cg_exo -63.39 131.03 30.35 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.125 1.883 . . . . 0.0 111.818 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -50.44 -51.62 45.11 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.442 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 6.4 p90 -51.39 -24.09 4.47 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 66.2 m -60.0 -19.96 55.26 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.134 0.493 . . . . 0.0 110.683 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.25 -11.54 57.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.442 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 59.0 mt-10 -72.0 119.84 76.75 Favored Pre-proline 0 N--CA 1.461 0.124 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.105 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -88.46 151.63 6.49 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 122.687 2.258 . . . . 0.0 112.033 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.435 ' HG3' ' CE2' ' A' ' 22' ' ' PHE . 73.8 Cg_endo -74.97 -172.14 1.17 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.316 2.011 . . . . 0.0 112.291 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 1.1 p90 -152.45 156.8 40.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -103.97 75.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.34 -164.59 40.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.535 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 77.72 6.89 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.64 0.257 . . . . 0.0 111.557 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.463 0.221 0 CA-C-O 120.953 0.406 . . . . 0.0 110.399 179.859 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.129 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mmm-85 -140.02 -177.03 4.81 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 111.965 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.558 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 10.0 m-85 -130.47 175.47 8.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.016 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.435 ' CE2' ' HG3' ' A' ' 9' ' ' PRO . 19.7 p90 -146.9 150.25 34.85 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.297 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.473 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 84.1 t80 -85.98 134.07 33.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.6 t-20 -104.69 92.28 4.21 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.79 -28.01 32.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.353 . . . . 0.0 111.291 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -1.14 47.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.94 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.48 -2.93 1.55 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.6 -4.35 4.08 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 114.532 0.573 . . . . 0.0 114.532 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -124.37 169.63 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.161 0.481 . . . . 0.0 111.418 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m -101.6 166.0 10.93 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.947 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.429 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -149.57 151.49 33.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.866 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -78.0 137.71 38.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.105 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 38' ' ' CYS . 84.0 m-85 -46.39 106.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.089 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.496 ' O ' ' HB3' ' A' ' 37' ' ' ALA . . . -74.3 -176.11 2.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.912 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.461 ' C ' ' H ' ' A' ' 37' ' ' ALA . 21.7 p90 -43.72 139.42 2.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.315 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.34 -8.35 0.04 OUTLIER Glycine 0 N--CA 1.438 -1.199 0 N-CA-C 114.65 0.62 . . . . 0.0 114.65 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 34' ' ' ALA . . . -71.7 105.19 3.62 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 117.597 0.698 . . . . 0.0 111.453 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -88.11 171.92 9.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.778 0.323 . . . . 0.0 111.036 179.517 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.44 141.26 50.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.82 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.99 174.63 6.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.062 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -62.9 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.607 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.5 mmm-85 -89.99 -34.49 15.97 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.62 79.11 2.0 Allowed 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.969 0.414 . . . . 0.0 110.972 -177.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -157.45 97.54 1.62 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.568 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 97.9 m-85 -105.08 140.4 38.31 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.3 -18.11 47.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.851 -178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.79 151.2 21.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 0.0 111.04 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.558 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -57.54 -38.28 74.46 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -61.38 -38.31 86.54 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.513 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.46 -45.29 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.969 178.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 1.4 t -60.66 -55.38 33.91 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.927 0.394 . . . . 0.0 110.119 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.431 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 71.6 mt -53.3 -43.22 67.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.367 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -52.36 65.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.761 0.315 . . . . 0.0 111.207 -179.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.9 m -79.16 -57.32 3.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -82.79 -37.21 24.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.431 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 N--CA 1.453 -0.223 0 C-N-CA 120.437 -0.887 . . . . 0.0 112.744 -179.387 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.409 ' HG3' HD21 ' A' ' 6' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.615 0.245 . . . . 0.0 111.195 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.414 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.9 Cg_exo -63.42 136.23 53.88 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.318 2.012 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -44.29 -61.71 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.415 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 33.4 p90 -51.05 -30.2 14.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 73.6 m -60.79 -20.24 61.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.106 0.479 . . . . 0.0 110.629 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.409 HD21 ' HG3' ' A' ' 1' ' ' ARG . 13.0 mt -80.25 -13.56 59.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.133 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.415 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 32.8 mt-10 -71.86 114.85 32.32 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.014 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 87.2 Cg_endo -85.0 152.08 11.06 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.46 2.107 . . . . 0.0 112.43 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 14.6 Cg_endo -90.34 -169.11 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.052 2.501 . . . . 0.0 111.671 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.498 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 39.9 p90 -152.33 133.24 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.884 0.373 . . . . 0.0 111.367 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -110.32 111.06 22.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.272 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -160.54 -109.88 0.26 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.49 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.16 78.32 6.83 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.0 m . . . . . 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.323 179.339 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.456 -0.154 0 CA-C-O 120.683 0.278 . . . . 0.0 111.195 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.452 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 1.5 mtp180 -132.11 164.38 26.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.252 0.548 . . . . 0.0 110.869 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CD1' ' N ' ' A' ' 21' ' ' TYR . 2.4 m-85 -143.68 177.95 8.14 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.706 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 19.1 p90 -149.5 157.33 43.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.031 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.471 ' CG ' ' HB3' ' A' ' 55' ' ' CYS . 60.6 t80 -84.38 144.39 28.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.927 0.394 . . . . 0.0 111.305 -179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -116.72 89.6 3.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.125 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.15 -24.49 10.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.432 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -3.87 58.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.931 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.27 -2.05 1.86 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.38 -3.26 8.32 Favored Glycine 0 N--CA 1.446 -0.664 0 N-CA-C 114.772 0.669 . . . . 0.0 114.772 178.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.22 175.74 7.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.342 0.571 . . . . 0.0 111.436 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.5 m -100.79 173.05 6.69 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.265 0.555 . . . . 0.0 111.605 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.13 151.61 34.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.996 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 t -77.42 149.06 35.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.88 0.371 . . . . 0.0 110.726 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.85 111.77 3.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.998 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.29 158.21 36.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.875 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -64.57 65.05 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.205 0.526 . . . . 0.0 111.355 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 171.68 -33.85 0.14 Allowed Glycine 0 N--CA 1.429 -1.813 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.574 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.64 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -65.77 124.15 21.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.498 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -81.93 153.81 26.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.565 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.32 118.38 11.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.244 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.64 168.02 19.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.889 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.407 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 2.7 tttp -60.97 -77.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.405 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 24.1 mmm-85 -92.86 -29.35 15.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.935 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.33 72.22 2.36 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.031 0.443 . . . . 0.0 111.03 -177.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 41' ' ' LYS . 5.0 p30 -159.5 101.71 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.496 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.6 m-85 -107.24 136.57 46.83 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.701 0.286 . . . . 0.0 110.473 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -64.36 -12.33 41.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.494 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -154.44 147.36 24.49 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.905 0.384 . . . . 0.0 111.387 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.93 81.61 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.624 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 13.6 mt-10 -58.51 -38.44 77.72 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.483 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.12 -46.48 74.03 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.412 ' O ' ' N ' ' A' ' 55' ' ' CYS . 7.7 t -63.72 -54.07 41.17 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.5 0.667 . . . . 0.0 109.591 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.413 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 19.9 mt -53.58 -42.75 67.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.641 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -61.51 -54.96 36.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 0.0 111.577 -179.537 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 m -77.76 -51.0 11.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.471 ' HB3' ' CG ' ' A' ' 23' ' ' TYR . 99.1 m -87.59 -37.11 17.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.413 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.273 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.014 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.587 0.232 . . . . 0.0 111.166 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 14.8 Cg_exo -65.02 131.96 30.51 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.267 1.978 . . . . 0.0 111.959 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.13 -55.82 9.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -51.03 -27.47 7.98 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 78.1 m -59.59 -23.82 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.161 0.505 . . . . 0.0 110.378 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mt -80.98 -13.53 58.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.622 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -73.12 117.07 56.97 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.756 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.12 160.46 45.44 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.14 1.893 . . . . 0.0 111.874 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HD3' ' CD2' ' A' ' 22' ' ' PHE . 5.9 Cg_exo -41.46 170.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.936 2.424 . . . . 0.0 112.996 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD1' ' N ' ' A' ' 11' ' ' ALA . 37.3 t80 -79.67 166.59 21.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.73 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.499 ' N ' ' CD1' ' A' ' 10' ' ' TYR . . . -137.9 91.61 2.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.198 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.24 -164.06 10.28 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.67 36.0 0.69 Allowed 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.8 m . . . . . 0 C--N 1.329 -0.322 0 CA-C-O 120.764 0.316 . . . . 0.0 110.718 179.973 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.877 0.37 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 32' ' ' THR . 4.2 mtm-85 -99.89 179.64 4.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.279 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.748 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 14.8 m-85 -135.63 168.5 19.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.468 ' CZ ' ' HB3' ' A' ' 31' ' ' GLN . 52.0 p90 -145.32 156.79 44.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.353 178.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -85.94 140.54 30.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.922 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.509 ' CG ' ' HB3' ' A' ' 27' ' ' ALA . 50.0 t-20 -107.53 89.29 2.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.009 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.84 -25.16 10.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.792 0.33 . . . . 0.0 111.309 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -92.49 1.84 57.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.094 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.509 ' HB3' ' CG ' ' A' ' 24' ' ' ASN . . . -139.69 -1.59 1.63 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 64.35 -4.45 1.37 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 0.1 OUTLIER -121.89 172.45 8.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 117.236 0.518 . . . . 0.0 111.096 -179.762 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.2 m -103.29 170.63 7.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.323 0.582 . . . . 0.0 111.194 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -151.08 143.49 24.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.186 179.74 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.433 ' N ' ' HG3' ' A' ' 31' ' ' GLN . 1.7 t -75.82 130.65 38.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.728 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 22' ' ' PHE . 64.9 m-85 -55.09 161.3 1.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.071 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.07 -159.28 0.38 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 112.029 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -36.91 140.86 0.14 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.143 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 43.99 38.44 4.66 Favored Glycine 0 N--CA 1.434 -1.444 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.229 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.63 91.61 0.76 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.102 0.477 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.429 ' N ' ' HB3' ' A' ' 10' ' ' TYR . 36.8 m -88.48 174.62 8.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.158 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.09 127.88 33.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.156 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.37 144.68 32.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.943 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -33.78 76.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.669 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -82.76 0.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.89 103.73 14.21 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.308 0.575 . . . . 0.0 111.596 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -159.15 106.99 1.81 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.883 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.501 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 88.7 m-85 -105.04 136.91 43.65 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.853 0.359 . . . . 0.0 110.866 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.63 -15.1 50.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.576 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.483 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -151.17 146.65 26.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.008 0.433 . . . . 0.0 111.235 179.931 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.748 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -59.49 -38.98 82.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.055 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -60.05 -38.48 82.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.501 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.93 -43.88 86.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.102 178.492 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER -62.25 -55.91 23.75 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.511 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.3 mt -55.04 -41.27 71.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.359 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -59.38 -51.34 70.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.828 0.347 . . . . 0.0 110.978 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.4 ' HB ' ' CZ ' ' A' ' 45' ' ' PHE . 7.0 m -80.02 -58.71 3.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.725 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 17.4 m -73.88 -43.99 56.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.255 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.736 -179.356 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 9.7 ptp85 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.493 0.187 . . . . 0.0 111.259 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 13.7 Cg_exo -67.77 132.45 26.78 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.437 2.091 . . . . 0.0 112.155 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -58.16 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.529 ' HB2' ' HB2' ' A' ' 42' ' ' ARG . 13.8 p90 -51.3 -26.61 7.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 78.5 m -60.08 -19.93 55.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.084 0.468 . . . . 0.0 110.409 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.404 HD21 ' HD2' ' A' ' 1' ' ' ARG . 17.9 mt -81.75 -7.09 59.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.842 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.443 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 31.7 mm-40 -71.19 118.83 69.39 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.242 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 10.0 Cg_exo -70.79 150.43 61.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.5 2.134 . . . . 0.0 112.112 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.4 Cg_endo -80.26 -176.97 3.47 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.744 2.296 . . . . 0.0 111.919 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -153.99 161.46 41.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.41 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -134.74 108.4 7.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.11 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 13' ' ' ALA . . . 172.74 143.94 4.38 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.454 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 12' ' ' GLY . . . 70.63 35.06 1.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 111.337 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.929 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.168 0 CA-C-O 120.655 0.264 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -146.13 168.0 22.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.595 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -137.23 173.15 11.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.914 0.388 . . . . 0.0 111.117 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.507 ' CE1' ' HB2' ' A' ' 31' ' ' GLN . 25.7 p90 -147.29 155.13 41.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.473 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -86.57 140.0 30.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -115.48 90.28 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.18 -29.67 33.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -79.05 -2.02 38.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.473 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.65 -1.84 2.01 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.77 -8.6 1.68 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 121.053 -0.594 . . . . 0.0 114.542 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.69 176.86 6.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 117.34 0.57 . . . . 0.0 111.253 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.1 m -97.34 171.43 8.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.335 0.588 . . . . 0.0 111.315 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.507 ' HB2' ' CE1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -146.54 142.46 28.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.601 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 t -75.43 137.9 41.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 110.624 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.467 ' HB3' ' HB3' ' A' ' 37' ' ' ALA . 47.3 m-85 -53.9 124.1 14.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.514 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.97 -171.45 1.34 Allowed 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.067 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -51.36 142.6 13.08 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.878 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 44.8 17.13 0.08 OUTLIER Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 115.556 -0.747 . . . . 0.0 114.92 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.467 ' HB3' ' HB3' ' A' ' 33' ' ' PHE . . . -69.74 -178.97 1.63 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 117.746 0.773 . . . . 0.0 110.321 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.433 ' O ' ' CE1' ' A' ' 33' ' ' PHE . 0.9 OUTLIER -155.17 152.07 28.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.124 0.487 . . . . 0.0 111.41 179.713 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.34 139.84 50.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.236 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -92.99 -174.32 3.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.088 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -80.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.691 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.529 ' HB2' ' HB2' ' A' ' 4' ' ' PHE . 8.4 mmt-85 -87.91 -33.77 18.38 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.21 71.84 2.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.12 0.486 . . . . 0.0 110.447 -178.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -156.02 92.99 1.4 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.668 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.523 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.3 m-85 -107.01 131.02 54.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -12.03 18.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.795 -179.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.73 148.95 24.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.921 0.391 . . . . 0.0 111.276 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.11 74.88 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -38.57 84.93 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.523 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -66.57 -46.41 76.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.286 178.594 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.444 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 2.4 t -60.58 -55.58 31.65 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-O 121.028 0.442 . . . . 0.0 110.144 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.407 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 47.7 mt -53.23 -42.54 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.553 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -59.7 -51.78 68.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.829 0.347 . . . . 0.0 111.147 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.0 m -78.66 -58.57 3.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.088 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 23.2 m -76.72 -41.15 46.25 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.407 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.24 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.485 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.616 0.246 . . . . 0.0 111.15 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.98 138.81 81.16 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.287 1.991 . . . . 0.0 112.091 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -61.96 1.41 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.403 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.473 ' HB2' ' CB ' ' A' ' 42' ' ' ARG . 20.4 p90 -51.99 -29.83 22.46 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.6 m -61.65 -18.15 58.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.088 0.47 . . . . 0.0 110.743 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.44 -12.11 59.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.968 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -72.42 114.39 29.32 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.964 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 93.7 Cg_endo -82.45 149.57 14.83 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.429 2.086 . . . . 0.0 112.192 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.572 ' HG3' ' CD2' ' A' ' 22' ' ' PHE . 72.9 Cg_endo -94.17 144.78 1.81 Allowed 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.034 2.489 . . . . 0.0 112.556 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -87.84 142.37 27.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.666 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.36 108.36 14.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.145 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.61 143.3 6.11 Favored Glycine 0 C--N 1.33 0.203 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.554 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.91 49.26 4.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 0.0 111.111 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.7 t . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.126 -179.739 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.466 0.35 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.455 ' HB2' ' CD2' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -142.96 179.07 7.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.95 0.405 . . . . 0.0 110.918 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.711 ' CE2' ' HB2' ' A' ' 48' ' ' ALA . 46.2 m-85 -128.97 155.15 45.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.987 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.572 ' CD2' ' HG3' ' A' ' 9' ' ' PRO . 18.7 p90 -145.7 152.66 39.95 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.317 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -84.73 139.41 32.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 29' ' ' LEU . 35.7 t-20 -112.4 88.06 2.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.345 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.71 -25.47 18.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.227 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -79.75 -4.77 53.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.616 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.3 1.1 1.76 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.73 -6.35 2.79 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 114.826 0.69 . . . . 0.0 114.826 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.444 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 2.3 mp -122.33 174.22 7.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.395 0.597 . . . . 0.0 111.341 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 22' ' ' PHE . 1.9 m -102.81 168.02 9.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.076 0.465 . . . . 0.0 110.936 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 23.5 mt-30 -148.39 156.87 43.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.609 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -79.75 147.8 31.73 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.864 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.455 ' CD2' ' HB2' ' A' ' 20' ' ' ARG . 42.0 m-85 -65.49 117.01 7.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.016 0.436 . . . . 0.0 111.373 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.71 -171.93 1.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.055 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -44.42 134.08 5.31 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.782 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 39.01 26.02 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 114.842 0.697 . . . . 0.0 114.842 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.438 ' HB3' ' HB3' ' A' ' 33' ' ' PHE . . . -69.36 168.39 14.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 117.207 0.503 . . . . 0.0 110.466 179.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 21.1 m -155.64 145.63 21.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 111.911 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.418 ' HB1' ' HB2' ' A' ' 44' ' ' ASN . . . -70.09 174.84 4.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 41' ' ' LYS . . . -124.08 34.01 5.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.894 0.378 . . . . 0.0 111.387 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . 0.486 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER 91.19 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.487 179.149 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.473 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER -88.03 -40.22 14.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.82 -178.867 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.26 72.4 2.32 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.129 0.49 . . . . 0.0 110.521 -177.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.418 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 16.0 t30 -156.0 93.51 1.45 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.821 -179.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.594 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 99.5 m-85 -105.54 130.2 53.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -63.02 -12.98 29.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.293 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -150.35 145.47 26.14 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.951 0.405 . . . . 0.0 111.391 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.711 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . . . -60.26 -34.58 73.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.596 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 0.7 OUTLIER -60.13 -39.2 85.45 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.027 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -65.13 -47.61 76.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.438 178.661 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.422 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 3.0 t -60.81 -52.95 62.89 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.366 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.4 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 95.5 mt -56.31 -45.12 80.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.485 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -59.23 -45.38 91.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.77 0.319 . . . . 0.0 111.097 -179.616 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.4 m -81.05 -62.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -85.49 -29.44 24.27 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.4 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.517 0.179 0 C-N-CA 120.164 -1.017 . . . . 0.0 112.386 -179.583 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 7.6 ptp180 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.373 0.13 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 20.8 Cg_exo -60.91 136.53 66.47 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.991 1.794 . . . . 0.0 111.717 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.11 -56.65 8.45 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -52.05 -23.6 5.48 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.635 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 70.7 m -62.05 -17.48 57.54 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.978 0.418 . . . . 0.0 110.647 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.1 mt -82.93 -14.53 53.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.231 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.63 119.23 74.02 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.195 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -85.98 156.73 10.01 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.656 2.237 . . . . 0.0 112.258 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.405 ' HG3' ' CD2' ' A' ' 22' ' ' PHE . 91.2 Cg_endo -88.63 -177.84 1.82 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.695 2.264 . . . . 0.0 112.029 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 27.4 p90 -152.94 152.07 31.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.914 0.388 . . . . 0.0 111.115 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -125.48 124.07 40.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.337 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -178.45 89.08 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.189 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.49 94.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.852 0.358 . . . . 0.0 111.186 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.2 m . . . . . 0 C--N 1.33 -0.243 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.591 179.83 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.149 0 CA-C-O 120.615 0.245 . . . . 0.0 111.526 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -137.47 166.42 23.91 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.434 178.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -136.07 165.48 25.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 111.755 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.488 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 12.5 p90 -144.53 153.08 41.46 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.56 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.635 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 82.9 t80 -84.43 139.71 32.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.158 0.504 . . . . 0.0 111.707 -178.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -115.62 90.15 3.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.024 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.42 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . . . -52.74 -28.53 22.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.8 0.333 . . . . 0.0 111.356 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -1.84 37.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.611 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.69 -3.07 1.5 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.98 -3.73 3.78 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.57 172.8 9.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.231 0.516 . . . . 0.0 111.39 -179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 2.0 m -100.41 170.11 8.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.074 0.464 . . . . 0.0 111.485 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -147.99 151.51 35.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.444 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.528 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 1.5 t -74.22 147.18 42.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.429 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -74.72 131.15 40.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.559 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.52 157.68 37.15 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.64 64.13 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.205 0.526 . . . . 0.0 110.822 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 168.77 -27.95 0.14 Allowed Glycine 0 N--CA 1.429 -1.805 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.362 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -63.35 129.99 42.6 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.932 0.396 . . . . 0.0 111.656 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 13.6 m -83.5 149.62 26.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.976 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.65 164.01 24.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.781 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -112.72 168.15 9.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.113 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -63.78 -75.35 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.593 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 -86.26 -31.9 21.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.484 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.45 ' O ' ' HB3' ' A' ' 44' ' ' ASN . 0.5 OUTLIER -73.79 -177.01 2.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.13 0.49 . . . . 0.0 109.955 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 43' ' ' ASN . 56.5 t-20 74.0 115.65 0.06 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.62 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.447 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 64.2 m-85 -119.41 144.48 46.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.756 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -16.3 59.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.621 0.248 . . . . 0.0 111.434 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.85 146.21 25.51 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 111.32 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.77 81.03 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.092 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 2.0 tt0 -58.68 -39.86 81.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.447 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.56 -43.22 90.52 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.398 178.473 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.404 ' O ' ' N ' ' A' ' 55' ' ' CYS . 3.6 t -62.22 -58.19 8.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.16 0.505 . . . . 0.0 109.867 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.76 -44.97 70.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.846 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -59.36 -50.39 74.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.735 0.303 . . . . 0.0 111.206 -179.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -78.29 -61.25 2.07 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.433 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.8 OUTLIER -74.54 -41.37 60.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 0.218 0 C-N-CA 120.396 -0.907 . . . . 0.0 112.445 -179.658 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.453 ' NE ' HD21 ' A' ' 6' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.556 0.217 . . . . 0.0 111.12 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -52.97 132.77 48.98 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.055 1.837 . . . . 0.0 111.768 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -47.74 -51.92 20.42 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.413 ' CB ' ' HG3' ' A' ' 42' ' ' ARG . 2.8 p90 -52.23 -22.32 4.27 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.837 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.524 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.6 m -57.78 -20.29 34.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.167 0.508 . . . . 0.0 110.428 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.453 HD21 ' NE ' ' A' ' 1' ' ' ARG . 36.5 mt -82.21 -17.55 45.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.145 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 28.7 tp10 -75.45 111.43 14.09 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.454 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 36.9 Cg_endo -94.18 158.71 2.12 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 122.955 2.436 . . . . 0.0 112.292 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.94 -162.74 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.627 2.218 . . . . 0.0 112.095 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 18.6 p90 -150.21 144.92 25.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -110.55 115.14 29.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.848 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.37 138.62 3.05 Favored Glycine 0 C--N 1.328 0.111 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.211 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.38 45.4 8.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.046 0.451 . . . . 0.0 110.392 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.73 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.041 -179.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.185 0 CA-C-O 120.779 0.323 . . . . 0.0 111.049 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.72 -177.79 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.22 0.533 . . . . 0.0 111.068 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -131.97 166.87 20.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.972 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -143.27 152.57 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.468 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.524 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 78.4 t80 -86.74 143.46 27.54 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.994 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . 0.416 ' HB3' ' HB3' ' A' ' 27' ' ' ALA . 51.9 t-20 -115.01 102.07 9.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.621 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.8 -27.0 59.2 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.31 -13.63 43.08 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.416 ' HB3' ' HB3' ' A' ' 24' ' ' ASN . . . -115.04 -14.03 11.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.62 0.248 . . . . 0.0 111.664 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.68 -6.44 25.1 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 121.066 -0.587 . . . . 0.0 113.721 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 mp -127.69 176.61 7.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 0.0 110.796 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 m -101.61 168.17 9.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.256 0.551 . . . . 0.0 111.204 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -152.17 145.13 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.311 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.52 145.84 32.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.583 ' CE2' ' HA ' ' A' ' 39' ' ' ALA . 78.7 m-85 -58.61 134.47 56.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.446 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -164.68 171.89 13.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.793 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.1 t80 54.71 62.54 2.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.345 0.593 . . . . 0.0 110.394 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.73 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . 52.4 5.82 0.23 Allowed Glycine 0 N--CA 1.436 -1.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 114.407 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.81 126.12 26.96 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.076 0.938 . . . . 0.0 111.122 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -85.49 174.51 9.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.511 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.583 ' HA ' ' CE2' ' A' ' 33' ' ' PHE . . . -72.3 129.49 38.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.597 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.0 165.45 24.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.435 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -62.5 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.196 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.413 ' HG3' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -93.77 -24.72 17.69 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.13 79.3 2.27 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.95 0.405 . . . . 0.0 110.377 -178.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -155.52 105.48 2.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.514 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.565 ' HE1' HG21 ' A' ' 54' ' ' THR . 86.8 m-85 -103.47 140.53 37.37 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.02 -15.3 30.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.783 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -165.85 154.33 11.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.896 0.379 . . . . 0.0 111.08 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.16 -38.08 75.93 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -60.32 -36.71 78.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -49.11 65.63 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.562 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 19.0 t -62.27 -55.63 26.45 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.891 0.377 . . . . 0.0 110.558 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.52 ' HA ' ' HA3' ' A' ' 56' ' ' GLY . 79.5 mt -51.77 -52.59 47.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.85 -35.28 70.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.816 0.341 . . . . 0.0 110.77 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.565 HG21 ' HE1' ' A' ' 45' ' ' PHE . 23.0 m -80.07 -70.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.798 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.1 t -96.89 -23.07 16.52 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . 0.52 ' HA3' ' HA ' ' A' ' 52' ' ' LEU . . . . . . . . 0 CA--C 1.518 0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.926 -179.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.415 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 16.6 Cg_exo -61.91 135.16 53.95 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.021 1.814 . . . . 0.0 111.888 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.19 -58.46 4.5 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . 0.511 ' HB3' ' HB3' ' A' ' 42' ' ' ARG . 8.2 p90 -49.93 -25.07 2.91 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.649 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.1 m -60.88 -26.18 67.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.123 0.487 . . . . 0.0 110.523 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 mt -83.63 -13.22 54.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.92 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.49 114.89 33.93 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.413 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -93.79 153.71 2.3 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.01 2.474 . . . . 0.0 112.089 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -78.13 147.26 23.39 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.398 2.065 . . . . 0.0 112.255 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.526 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 10.4 p90 -84.69 130.01 34.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -97.86 88.06 4.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 154.01 152.71 6.16 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.572 -0.823 . . . . 0.0 112.498 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 58.96 37.48 24.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.914 0.388 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 48.0 t . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.383 -179.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.117 0 N-CA-C 112.211 0.449 . . . . 0.0 112.211 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.456 ' HB2' ' CD1' ' A' ' 33' ' ' PHE . 6.6 mtp85 -142.38 158.42 43.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 111.038 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.591 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 3.1 m-85 -140.91 172.33 12.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.211 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -150.6 156.28 41.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.113 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.649 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -83.42 138.27 33.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.072 0.463 . . . . 0.0 110.965 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -105.4 91.39 3.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.319 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.57 -22.81 9.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.61 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.19 -1.6 57.68 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.59 -3.6 1.87 Allowed 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.413 ' HA2' ' OH ' ' A' ' 23' ' ' TYR . . . 70.44 -7.73 4.65 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 114.882 0.713 . . . . 0.0 114.882 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.1 mp -123.52 171.37 9.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.488 0.644 . . . . 0.0 111.674 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.4 m -101.68 164.27 11.83 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-O 121.386 0.612 . . . . 0.0 111.196 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -149.72 160.92 43.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.97 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 t -75.11 156.56 35.89 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.646 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.456 ' CD1' ' HB2' ' A' ' 20' ' ' ARG . 76.5 m-85 -72.89 98.68 2.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.255 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.452 ' O ' ' O ' ' A' ' 35' ' ' TYR . . . -77.08 164.0 26.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.708 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.847 ' CE1' ' HB2' ' A' ' 37' ' ' ALA . 19.9 p90 41.56 -169.9 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.538 0.685 . . . . 0.0 111.299 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . -65.06 28.38 0.11 Allowed Glycine 0 C--N 1.311 -0.819 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.12 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.847 ' HB2' ' CE1' ' A' ' 35' ' ' TYR . . . -67.15 128.3 35.87 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 118.449 1.124 . . . . 0.0 110.83 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.526 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 0.3 OUTLIER -84.17 165.01 18.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.056 0.455 . . . . 0.0 111.468 -179.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.98 136.72 46.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.412 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.861 ' HB3' ' O ' ' A' ' 43' ' ' ASN . . . -69.37 152.93 44.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.865 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.28 -65.45 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.511 ' HB3' ' HB3' ' A' ' 4' ' ' PHE . 5.3 mtp180 -88.8 -54.05 4.33 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . 0.861 ' O ' ' HB3' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -84.6 96.94 9.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.571 0.7 . . . . 0.0 111.049 -178.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -156.81 95.49 1.53 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.668 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.522 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 85.0 m-85 -103.76 128.6 51.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.78 0.324 . . . . 0.0 110.911 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mttt -63.43 -13.49 40.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.923 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.32 142.41 33.84 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.017 0.437 . . . . 0.0 111.127 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.591 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -61.98 -38.17 87.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.336 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -58.99 -38.62 79.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.522 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -65.65 -44.05 87.54 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.201 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 55' ' ' CYS . 2.0 t -61.43 -55.34 32.48 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 88.7 mt -53.26 -42.93 66.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.293 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.51 79.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.864 0.364 . . . . 0.0 110.515 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.445 ' HG1' ' HE2' ' A' ' 45' ' ' PHE . 8.0 m -80.13 -62.89 1.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.835 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.451 ' N ' ' O ' ' A' ' 51' ' ' CYS . 1.5 m -72.12 -44.69 62.78 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.235 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.681 -179.33 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' ARG . . . . . 0.63 ' NH2' ' HB1' ' A' ' 25' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.664 0.269 . . . . 0.0 111.247 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' PRO . . . . . 0.479 ' HG2' ' HA ' ' A' ' 55' ' ' CYS . 25.5 Cg_exo -58.14 152.09 54.63 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.239 1.959 . . . . 0.0 112.041 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -49.03 -61.31 2.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.673 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -55.12 -22.98 18.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.71 0.291 . . . . 0.0 111.245 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' CYS . . . . . 0.453 ' SG ' ' CD2' ' A' ' 23' ' ' TYR . 0.1 OUTLIER -60.46 -20.05 58.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.149 0.5 . . . . 0.0 109.964 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.5 HD23 ' HE ' ' A' ' 1' ' ' ARG . 16.5 mt -82.13 -17.06 47.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.409 178.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.35 114.21 27.66 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.007 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -85.37 156.71 10.88 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.572 2.182 . . . . 0.0 112.248 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PRO . . . . . 0.53 ' HG3' ' CD1' ' A' ' 22' ' ' PHE . 62.7 Cg_endo -85.87 176.15 5.49 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.636 2.224 . . . . 0.0 111.408 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . 0.457 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 1.1 p90 -155.74 149.73 25.45 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 111.771 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -117.62 107.79 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.46 -115.32 0.95 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.256 -0.973 . . . . 0.0 113.719 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.411 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -75.55 77.75 2.57 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -178.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 13' ' ' ALA . 88.0 m . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.031 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.549 0.214 . . . . 0.0 111.277 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -142.85 167.87 21.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.463 0.649 . . . . 0.0 111.216 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.4 ' CZ ' HG23 ' A' ' 32' ' ' THR . 61.6 m-85 -139.65 167.14 22.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.156 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PHE . . . . . 0.53 ' CD1' ' HG3' ' A' ' 9' ' ' PRO . 13.6 p90 -149.14 146.65 27.78 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.477 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CD2' ' SG ' ' A' ' 5' ' ' CYS . 83.5 t80 -83.93 132.07 34.8 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.922 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -102.23 98.1 8.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.502 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.63 ' HB1' ' NH2' ' A' ' 1' ' ' ARG . . . -53.57 -33.12 53.63 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.385 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -83.23 3.35 31.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.953 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.53 -4.76 1.81 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.28 -6.62 2.22 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.886 0.715 . . . . 0.0 114.886 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.45 171.55 11.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.524 0.662 . . . . 0.0 111.225 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.513 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 1.6 m -96.35 168.39 10.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.114 0.483 . . . . 0.0 111.197 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 4.0 tt0 -147.62 152.71 38.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.737 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' THR . . . . . 0.4 HG23 ' CZ ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -76.62 134.46 39.32 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.821 179.078 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -61.01 166.63 3.39 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.684 ' H ' ' HB3' ' A' ' 37' ' ' ALA . . . -168.52 -152.32 0.11 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.801 -179.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.423 ' C ' ' H ' ' A' ' 37' ' ' ALA . 12.9 t80 -39.51 121.69 1.24 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 11' ' ' ALA . . . 54.17 -2.92 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.167 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ALA . . . . . 0.684 ' HB3' ' H ' ' A' ' 34' ' ' ALA . . . -67.44 106.82 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.967 0.883 . . . . 0.0 110.881 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' CYS . . . . . 0.457 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 70.8 m -82.82 145.23 29.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.45 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 138.69 49.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.226 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -87.84 164.4 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.794 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -71.73 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.651 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -86.12 -38.74 17.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.068 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.62 70.04 2.4 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 121.229 0.538 . . . . 0.0 110.306 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -155.77 92.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.165 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.547 ' CG ' ' HA ' ' A' ' 51' ' ' CYS . 81.2 m-85 -106.29 134.47 49.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 110.662 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -13.75 25.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.021 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.66 150.84 26.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 0.0 111.095 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.37 -38.98 78.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -37.88 81.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . 0.506 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.22 -42.98 83.14 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.288 178.597 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.547 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 5.3 t -63.83 -59.76 4.13 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 121.159 0.504 . . . . 0.0 109.815 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -52.64 -42.28 64.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.436 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -59.16 -51.69 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.825 0.345 . . . . 0.0 111.181 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.404 ' HB ' ' CE1' ' A' ' 45' ' ' PHE . 2.0 m -79.96 -59.92 2.54 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.467 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' CYS . . . . . 0.479 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -69.63 -47.77 62.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.866 -178.846 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.268 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.582 -179.36 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.417 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.392 0 CA-C-O 120.577 0.227 . . . . 0.0 111.035 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.563 ' HG2' HG22 ' A' ' 54' ' ' THR . 37.9 Cg_exo -58.09 136.42 74.81 Favored 'Trans proline' 0 C--N 1.347 0.45 0 C-N-CA 122.405 2.07 . . . . 0.0 112.368 -179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -46.56 -60.02 2.63 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.076 -0.511 . . . . 0.0 112.008 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.449 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 27.3 p90 -51.66 -29.83 19.45 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.642 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.472 ' HB2' ' O ' ' A' ' 2' ' ' PRO . 66.9 m -59.46 -21.03 59.47 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.012 0.434 . . . . 0.0 110.699 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 13.4 mt -81.86 -11.39 58.96 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.225 179.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.449 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 6.8 mt-10 -72.24 114.88 33.34 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.539 -179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -87.9 158.19 7.38 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.575 2.183 . . . . 0.0 111.896 179.361 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.461 ' HG3' ' CZ ' ' A' ' 22' ' ' PHE . 95.0 Cg_endo -77.12 143.08 22.32 Favored 'Trans proline' 0 C--N 1.343 0.256 0 C-N-CA 122.318 2.012 . . . . 0.0 112.371 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.532 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 27.8 p90 -87.94 130.63 34.88 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.912 179.629 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -98.24 94.0 6.54 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.265 -179.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -118.61 -95.73 1.71 Allowed Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.323 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -161.89 97.96 1.06 Allowed 'General case' 0 N--CA 1.44 -0.959 0 CA-C-O 120.849 0.357 . . . . 0.0 111.44 179.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 8.9 p -165.37 130.14 2.46 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.782 179.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -80.74 127.45 32.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.585 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -166.44 147.43 6.32 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.014 179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -161.54 44.34 0.16 Allowed 'General case' 0 N--CA 1.446 -0.658 0 CA-C-O 121.18 0.514 . . . . 0.0 111.062 179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.81 161.83 30.36 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.873 179.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -79.48 45.26 0.66 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.395 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.2 OUTLIER -102.02 164.01 11.94 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.129 0.49 . . . . 0.0 111.237 -179.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.82 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 48.6 m-85 -136.84 156.69 48.16 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.965 179.857 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.552 ' HB2' ' OD1' ' A' ' 43' ' ' ASN . 8.3 p90 -144.42 159.9 41.97 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.56 178.402 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 65.0 t80 -86.74 145.15 26.76 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.692 -178.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.414 ' HB3' ' O ' ' A' ' 29' ' ' LEU . 37.0 t-20 -114.26 87.95 2.75 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.648 178.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.23 -23.84 6.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.673 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -88.68 -0.96 57.8 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -141.43 -1.94 1.28 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 112.827 0.677 . . . . 0.0 112.827 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.09 -3.29 4.28 Favored Glycine 0 N--CA 1.446 -0.672 0 C-N-CA 121.04 -0.6 . . . . 0.0 114.515 179.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.414 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 0.0 OUTLIER -118.76 171.93 7.87 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 117.088 0.444 . . . . 0.0 111.016 -179.737 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.455 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 11.7 m -100.86 177.66 4.9 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 121.256 0.55 . . . . 0.0 111.267 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.471 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 2.7 tp60 -149.39 138.7 21.47 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.358 179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.451 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 5.2 t -83.23 31.8 0.45 Allowed 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.38 178.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.444 ' CE1' ' HA ' ' A' ' 39' ' ' ALA . 90.4 m-85 65.48 159.63 0.12 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.393 -179.69 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -167.12 172.71 9.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.624 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 43.75 -165.6 0.01 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.439 0.637 . . . . 0.0 110.7 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.29 22.11 0.82 Allowed Glycine 0 C--N 1.311 -0.835 0 CA-C-N 115.263 -0.88 . . . . 0.0 112.818 179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -65.61 130.92 44.99 Favored 'General case' 0 CA--C 1.522 -0.104 0 CA-C-N 117.402 0.601 . . . . 0.0 110.956 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.532 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 1.2 m -84.21 153.76 23.44 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.159 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.444 ' HA ' ' CE1' ' A' ' 33' ' ' PHE . . . -69.42 132.48 46.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.949 179.53 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.411 ' HB3' ' O ' ' A' ' 43' ' ' ASN . . . -80.82 151.12 28.88 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.219 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.68 -65.42 0.68 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.973 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.444 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 10.1 mmp_? -85.46 -42.25 14.65 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.45 -179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.552 ' OD1' ' HB2' ' A' ' 22' ' ' PHE . 0.5 OUTLIER -74.93 69.61 1.9 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 121.161 0.505 . . . . 0.0 110.408 -177.858 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 44.3 p-10 -156.44 105.71 2.29 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.261 -179.404 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.506 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 83.3 m-85 -108.77 143.09 38.37 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-O 120.817 0.341 . . . . 0.0 110.641 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 50.6 mttp -63.39 -16.59 60.96 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.339 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.472 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -154.54 147.88 24.98 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.901 0.381 . . . . 0.0 111.164 -179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.82 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -59.44 -37.43 78.08 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.81 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.404 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 55.1 tt0 -60.54 -38.69 85.3 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.506 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -64.63 -45.31 87.4 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.203 178.434 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 5.1 t -61.01 -54.82 40.2 Favored 'General case' 0 C--N 1.339 0.114 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.446 HD23 ' SG ' ' A' ' 30' ' ' CYS . 95.3 mt -56.39 -38.23 71.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.381 179.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.404 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 8.2 ttp180 -60.55 -53.85 52.54 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.831 0.348 . . . . 0.0 111.013 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.563 HG22 ' HG2' ' A' ' 2' ' ' PRO . 18.9 m -79.31 -56.2 4.52 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.841 -179.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 73.7 m -76.52 -41.46 46.75 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.437 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -83.84 -152.24 13.62 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.541 -0.838 . . . . 0.0 112.121 -179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 137.59 -54.51 0.7 Allowed Glycine 0 C--N 1.329 0.174 0 C-N-CA 120.72 -0.753 . . . . 0.0 112.5 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.992 0 CA-C-O 118.216 -0.897 . . . . 0.0 111.093 -179.881 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.0 ttm105 . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 120.61 0.243 . . . . 0.0 111.125 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.429 ' HB3' ' CZ ' ' A' ' 4' ' ' PHE . 13.4 Cg_exo -63.39 131.03 30.35 Favored 'Trans proline' 0 C--N 1.347 0.466 0 C-N-CA 122.125 1.883 . . . . 0.0 111.818 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -50.44 -51.62 45.11 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -178.485 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.442 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 6.4 p90 -51.39 -24.09 4.47 Favored 'General case' 0 N--CA 1.466 0.339 0 N-CA-C 112.118 0.414 . . . . 0.0 112.118 -178.265 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 66.2 m -60.0 -19.96 55.26 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.134 0.493 . . . . 0.0 110.683 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 14.3 mt -83.25 -11.54 57.68 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.236 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.442 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 59.0 mt-10 -72.0 119.84 76.75 Favored Pre-proline 0 N--CA 1.461 0.124 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.105 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -88.46 151.63 6.49 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 122.687 2.258 . . . . 0.0 112.033 179.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.435 ' HG3' ' CE2' ' A' ' 22' ' ' PHE . 73.8 Cg_endo -74.97 -172.14 1.17 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.316 2.011 . . . . 0.0 112.291 179.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.48 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 1.1 p90 -152.45 156.8 40.18 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.026 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -103.97 75.13 1.26 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.015 -179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -88.34 -164.59 40.42 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.699 -0.762 . . . . 0.0 112.535 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.19 77.72 6.89 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-O 120.64 0.257 . . . . 0.0 111.557 -179.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 3.3 m -158.0 116.38 3.09 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 120.953 0.406 . . . . 0.0 110.399 179.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 38.0 mtp85 -86.62 23.31 1.69 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.974 -0.557 . . . . 0.0 112.125 -179.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -76.18 141.8 41.73 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 120.734 0.302 . . . . 0.0 110.969 179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -160.49 41.06 0.17 Allowed 'General case' 0 N--CA 1.447 -0.578 0 CA-C-O 121.296 0.569 . . . . 0.0 111.273 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -175.79 80.36 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.186 -0.915 . . . . 0.0 110.468 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -163.4 -55.14 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.384 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.0 mmm-85 -140.02 -177.03 4.81 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-O 121.234 0.54 . . . . 0.0 111.965 -179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.558 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 10.0 m-85 -130.47 175.47 8.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.016 -179.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.435 ' CE2' ' HG3' ' A' ' 9' ' ' PRO . 19.7 p90 -146.9 150.25 34.85 Favored 'General case' 0 CA--C 1.515 -0.394 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.297 178.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.473 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 84.1 t80 -85.98 134.07 33.89 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.784 179.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 35.6 t-20 -104.69 92.28 4.21 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.79 -28.01 32.6 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.842 0.353 . . . . 0.0 111.291 -179.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.09 -1.14 47.65 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.94 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.48 -2.93 1.55 Allowed 'General case' 0 CA--C 1.533 0.31 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.6 -4.35 4.08 Favored Glycine 0 N--CA 1.445 -0.729 0 N-CA-C 114.532 0.573 . . . . 0.0 114.532 179.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -124.37 169.63 11.63 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 117.161 0.481 . . . . 0.0 111.418 -179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.3 m -101.6 166.0 10.93 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.947 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.429 ' O ' ' CD1' ' A' ' 22' ' ' PHE . 0.1 OUTLIER -149.57 151.49 33.92 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.581 -0.736 . . . . 0.0 110.866 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -78.0 137.71 38.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.105 178.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.402 ' CE2' ' O ' ' A' ' 38' ' ' CYS . 84.0 m-85 -46.39 106.16 0.08 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.089 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.496 ' O ' ' HB3' ' A' ' 37' ' ' ALA . . . -74.3 -176.11 2.53 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.912 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.461 ' C ' ' H ' ' A' ' 37' ' ' ALA . 21.7 p90 -43.72 139.42 2.24 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.315 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 59.34 -8.35 0.04 OUTLIER Glycine 0 N--CA 1.438 -1.199 0 N-CA-C 114.65 0.62 . . . . 0.0 114.65 179.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.496 ' HB3' ' O ' ' A' ' 34' ' ' ALA . . . -71.7 105.19 3.62 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 117.597 0.698 . . . . 0.0 111.453 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.48 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.5 OUTLIER -88.11 171.92 9.9 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.778 0.323 . . . . 0.0 111.036 179.517 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.44 141.26 50.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.82 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -96.99 174.63 6.68 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.062 179.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 5.9 mttt -62.9 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.607 -179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 39.5 mmm-85 -89.99 -34.49 15.97 Favored 'General case' 0 C--N 1.332 -0.186 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -178.57 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.62 79.11 2.0 Allowed 'General case' 0 N--CA 1.451 -0.391 0 CA-C-O 120.969 0.414 . . . . 0.0 110.972 -177.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.3 p30 -157.45 97.54 1.62 Allowed 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.568 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.513 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 97.9 m-85 -105.08 140.4 38.31 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 109.994 -0.372 . . . . 0.0 109.994 179.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -60.3 -18.11 47.2 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.426 -0.352 . . . . 0.0 111.851 -178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -158.79 151.2 21.61 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.797 0.332 . . . . 0.0 111.04 -179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.558 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -57.54 -38.28 74.46 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -61.38 -38.31 86.54 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 108.038 -1.097 . . . . 0.0 108.038 177.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.513 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.46 -45.29 84.31 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.969 178.252 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.508 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 1.4 t -60.66 -55.38 33.91 Favored 'General case' 0 C--N 1.338 0.106 0 CA-C-O 120.927 0.394 . . . . 0.0 110.119 179.39 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.431 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 71.6 mt -53.3 -43.22 67.38 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.367 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.38 -52.36 65.94 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.761 0.315 . . . . 0.0 111.207 -179.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.9 m -79.16 -57.32 3.79 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 112.272 0.471 . . . . 0.0 112.272 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -82.79 -37.21 24.83 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.56 0.578 . . . . 0.0 112.56 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.431 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -70.06 148.72 46.55 Favored Glycine 0 N--CA 1.453 -0.223 0 C-N-CA 120.437 -0.887 . . . . 0.0 112.744 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -165.73 29.82 0.2 Allowed Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.379 179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.071 179.938 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.409 ' HG3' HD21 ' A' ' 6' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.615 0.245 . . . . 0.0 111.195 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.414 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 20.9 Cg_exo -63.42 136.23 53.88 Favored 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.318 2.012 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -44.29 -61.71 1.41 Allowed 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 -178.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.415 ' HA ' ' HG3' ' A' ' 7' ' ' GLU . 33.4 p90 -51.05 -30.2 14.98 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 112.633 0.605 . . . . 0.0 112.633 -178.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.414 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 73.6 m -60.79 -20.24 61.11 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.106 0.479 . . . . 0.0 110.629 179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.409 HD21 ' HG3' ' A' ' 1' ' ' ARG . 13.0 mt -80.25 -13.56 59.11 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.879 -0.601 . . . . 0.0 111.133 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.415 ' HG3' ' HA ' ' A' ' 4' ' ' PHE . 32.8 mt-10 -71.86 114.85 32.32 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 116.644 -0.253 . . . . 0.0 111.014 179.793 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 87.2 Cg_endo -85.0 152.08 11.06 Favored 'Trans proline' 0 C--N 1.347 0.487 0 C-N-CA 122.46 2.107 . . . . 0.0 112.43 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 14.6 Cg_endo -90.34 -169.11 0.32 Allowed 'Trans proline' 0 N--CA 1.453 -0.866 0 C-N-CA 123.052 2.501 . . . . 0.0 111.671 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.498 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 39.9 p90 -152.33 133.24 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.884 0.373 . . . . 0.0 111.367 179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -110.32 111.06 22.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.272 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -160.54 -109.88 0.26 Allowed Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.49 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -80.16 78.32 6.83 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 111.958 0.355 . . . . 0.0 111.958 -179.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 4.0 m -156.47 175.08 14.49 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.82 0.343 . . . . 0.0 110.323 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -154.48 88.41 1.21 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.006 -179.704 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -164.72 142.9 6.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.017 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -159.16 47.05 0.3 Allowed 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.744 179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.66 -176.5 1.63 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.943 179.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -78.1 63.33 3.04 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.195 179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.452 ' C ' ' CD1' ' A' ' 21' ' ' TYR . 1.5 mtp180 -132.11 164.38 26.41 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.252 0.548 . . . . 0.0 110.869 179.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.457 ' CD1' ' N ' ' A' ' 21' ' ' TYR . 2.4 m-85 -143.68 177.95 8.14 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.706 -179.176 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.422 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 19.1 p90 -149.5 157.33 43.18 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.031 178.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.471 ' CG ' ' HB3' ' A' ' 55' ' ' CYS . 60.6 t80 -84.38 144.39 28.83 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.927 0.394 . . . . 0.0 111.305 -179.286 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 37.0 t-20 -116.72 89.6 3.15 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.937 -0.574 . . . . 0.0 110.125 179.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.15 -24.49 10.75 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.432 -179.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.43 -3.87 58.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.931 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -138.27 -2.05 1.86 Allowed 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 69.38 -3.26 8.32 Favored Glycine 0 N--CA 1.446 -0.664 0 N-CA-C 114.772 0.669 . . . . 0.0 114.772 178.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -127.22 175.74 7.93 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 117.342 0.571 . . . . 0.0 111.436 -179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.422 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.5 m -100.79 173.05 6.69 Favored 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 121.265 0.555 . . . . 0.0 111.605 -179.893 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -149.13 151.61 34.68 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.996 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.7 t -77.42 149.06 35.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.88 0.371 . . . . 0.0 110.726 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 16.0 m-85 -66.85 111.77 3.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.998 179.612 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.471 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.29 158.21 36.25 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.595 -0.275 . . . . 0.0 110.875 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -64.57 65.05 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.205 0.526 . . . . 0.0 111.355 -179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.471 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 171.68 -33.85 0.14 Allowed Glycine 0 N--CA 1.429 -1.813 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.574 -179.43 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.64 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -65.77 124.15 21.66 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-O 120.9 0.381 . . . . 0.0 110.932 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.498 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 0.8 OUTLIER -81.93 153.81 26.1 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.565 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -68.32 118.38 11.34 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.244 -179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.64 168.02 19.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.889 179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.407 ' O ' ' ND2' ' A' ' 44' ' ' ASN . 2.7 tttp -60.97 -77.15 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.08 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.405 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 24.1 mmm-85 -92.86 -29.35 15.99 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.935 -179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.33 72.22 2.36 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 121.031 0.443 . . . . 0.0 111.03 -177.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.407 ' ND2' ' O ' ' A' ' 41' ' ' LYS . 5.0 p30 -159.5 101.71 1.53 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.496 -179.96 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.483 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.6 m-85 -107.24 136.57 46.83 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.701 0.286 . . . . 0.0 110.473 179.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 1.2 ttpm? -64.36 -12.33 41.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.494 -179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -154.44 147.36 24.49 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 120.905 0.384 . . . . 0.0 111.387 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.15 -37.93 81.61 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 116.004 -0.544 . . . . 0.0 109.624 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 13.6 mt-10 -58.51 -38.44 77.72 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.451 -0.944 . . . . 0.0 108.451 178.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.483 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.12 -46.48 74.03 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.218 179.064 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.412 ' O ' ' N ' ' A' ' 55' ' ' CYS . 7.7 t -63.72 -54.07 41.17 Favored 'General case' 0 CA--C 1.521 -0.167 0 CA-C-O 121.5 0.667 . . . . 0.0 109.591 179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.413 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 19.9 mt -53.58 -42.75 67.94 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.001 -0.999 . . . . 0.0 111.641 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.42 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -61.51 -54.96 36.46 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.725 0.298 . . . . 0.0 111.577 -179.537 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 6.9 m -77.76 -51.0 11.23 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 -178.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.471 ' HB3' ' CG ' ' A' ' 23' ' ' TYR . 99.1 m -87.59 -37.11 17.11 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 -178.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.413 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -70.76 83.63 0.38 Allowed Glycine 0 CA--C 1.518 0.273 0 C-N-CA 120.505 -0.855 . . . . 0.0 113.014 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -98.59 26.95 21.87 Favored Glycine 0 CA--C 1.518 0.226 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.637 179.607 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 111.218 179.937 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.587 0.232 . . . . 0.0 111.166 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 14.8 Cg_exo -65.02 131.96 30.51 Favored 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.267 1.978 . . . . 0.0 111.959 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -48.13 -55.82 9.37 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 13.8 p90 -51.03 -27.47 7.98 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.411 ' SG ' ' HB2' ' A' ' 2' ' ' PRO . 78.1 m -59.59 -23.82 63.26 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.161 0.505 . . . . 0.0 110.378 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 11.2 mt -80.98 -13.53 58.79 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.622 179.486 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -73.12 117.07 56.97 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.756 179.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -73.12 160.46 45.44 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.14 1.893 . . . . 0.0 111.874 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.421 ' HD3' ' CD2' ' A' ' 22' ' ' PHE . 5.9 Cg_exo -41.46 170.22 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.936 2.424 . . . . 0.0 112.996 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.499 ' CD1' ' N ' ' A' ' 11' ' ' ALA . 37.3 t80 -79.67 166.59 21.68 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.35 -0.841 . . . . 0.0 110.73 179.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.499 ' N ' ' CD1' ' A' ' 10' ' ' TYR . . . -137.9 91.61 2.59 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.198 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -144.24 -164.06 10.28 Favored Glycine 0 N--CA 1.453 -0.219 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.525 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -86.67 36.0 0.69 Allowed 'General case' 0 N--CA 1.442 -0.851 0 N-CA-C 112.102 0.408 . . . . 0.0 112.102 -179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 1.8 m -76.14 156.94 33.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.764 0.316 . . . . 0.0 110.718 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -158.66 103.96 1.76 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.848 0.356 . . . . 0.0 111.294 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 64.99 95.47 0.05 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.61 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -162.57 50.94 0.19 Allowed 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.118 179.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.08 123.79 22.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.55 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -165.0 -48.8 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.144 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.403 ' O ' ' HA ' ' A' ' 32' ' ' THR . 4.2 mtm-85 -99.89 179.64 4.45 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.279 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.748 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 14.8 m-85 -135.63 168.5 19.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.007 179.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.468 ' CZ ' ' HB3' ' A' ' 31' ' ' GLN . 52.0 p90 -145.32 156.79 44.01 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.353 178.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 67.4 t80 -85.94 140.54 30.25 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.922 -179.825 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.509 ' CG ' ' HB3' ' A' ' 27' ' ' ALA . 50.0 t-20 -107.53 89.29 2.95 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.009 179.318 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -52.84 -25.16 10.65 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.792 0.33 . . . . 0.0 111.309 -179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.6 mttt -92.49 1.84 57.02 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.251 -0.431 . . . . 0.0 112.094 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.509 ' HB3' ' CG ' ' A' ' 24' ' ' ASN . . . -139.69 -1.59 1.63 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 112.794 0.665 . . . . 0.0 112.794 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 64.35 -4.45 1.37 Allowed Glycine 0 N--CA 1.447 -0.598 0 N-CA-C 114.583 0.593 . . . . 0.0 114.583 179.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 0.1 OUTLIER -121.89 172.45 8.18 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 117.236 0.518 . . . . 0.0 111.096 -179.762 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.453 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.2 m -103.29 170.63 7.84 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 121.323 0.582 . . . . 0.0 111.194 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.468 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -151.08 143.49 24.22 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.186 179.74 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.433 ' N ' ' HG3' ' A' ' 31' ' ' GLN . 1.7 t -75.82 130.65 38.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.308 -0.405 . . . . 0.0 110.728 178.679 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.43 ' CZ ' ' HB3' ' A' ' 22' ' ' PHE . 64.9 m-85 -55.09 161.3 1.75 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.071 -179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -166.07 -159.28 0.38 Allowed 'General case' 0 C--O 1.241 0.633 0 CA-C-O 121.163 0.506 . . . . 0.0 112.029 -179.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -36.91 140.86 0.14 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.143 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 43.99 38.44 4.66 Favored Glycine 0 N--CA 1.434 -1.444 0 C-N-CA 121.182 -0.532 . . . . 0.0 113.229 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -162.63 91.61 0.76 Allowed 'General case' 0 N--CA 1.455 -0.206 0 CA-C-O 121.102 0.477 . . . . 0.0 111.153 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.429 ' N ' ' HB3' ' A' ' 10' ' ' TYR . 36.8 m -88.48 174.62 8.0 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.158 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -73.09 127.88 33.86 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.998 -0.547 . . . . 0.0 112.156 179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -80.37 144.68 32.52 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.943 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.37 -33.78 76.27 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.669 -179.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.57 -82.76 0.16 Allowed 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.553 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -84.89 103.73 14.21 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 121.308 0.575 . . . . 0.0 111.596 -178.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -159.15 106.99 1.81 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.883 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.501 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 88.7 m-85 -105.04 136.91 43.65 Favored 'General case' 0 C--O 1.231 0.113 0 CA-C-O 120.853 0.359 . . . . 0.0 110.866 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -62.63 -15.1 50.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.576 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.483 ' HA ' ' CE1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -151.17 146.65 26.26 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.008 0.433 . . . . 0.0 111.235 179.931 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.748 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -59.49 -38.98 82.31 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.055 179.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -60.05 -38.48 82.94 Favored 'General case' 0 N--CA 1.45 -0.455 0 N-CA-C 108.371 -0.974 . . . . 0.0 108.371 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.501 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.93 -43.88 86.78 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.132 -0.94 . . . . 0.0 110.102 178.492 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 55' ' ' CYS . 0.7 OUTLIER -62.25 -55.91 23.75 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 179.511 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 63.3 mt -55.04 -41.27 71.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.359 179.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 24.8 ttm180 -59.38 -51.34 70.35 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.828 0.347 . . . . 0.0 110.978 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.4 ' HB ' ' CZ ' ' A' ' 45' ' ' PHE . 7.0 m -80.02 -58.71 3.03 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.152 -0.477 . . . . 0.0 111.725 -179.755 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.425 ' N ' ' O ' ' A' ' 51' ' ' CYS . 17.4 m -73.88 -43.99 56.76 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 112.376 0.509 . . . . 0.0 112.376 -178.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -64.2 154.91 46.93 Favored Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.527 -0.844 . . . . 0.0 112.736 -179.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -170.88 -68.06 0.04 OUTLIER Glycine 0 N--CA 1.452 -0.259 0 C-N-CA 120.834 -0.698 . . . . 0.0 112.443 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.238 -0.887 . . . . 0.0 111.608 179.882 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 9.7 ptp85 . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.493 0.187 . . . . 0.0 111.259 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 13.7 Cg_exo -67.77 132.45 26.78 Favored 'Trans proline' 0 C--N 1.349 0.564 0 C-N-CA 122.437 2.091 . . . . 0.0 112.155 -179.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -47.8 -58.16 4.7 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 -178.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.529 ' HB2' ' HB2' ' A' ' 42' ' ' ARG . 13.8 p90 -51.3 -26.61 7.7 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -178.089 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.473 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 78.5 m -60.08 -19.93 55.58 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.084 0.468 . . . . 0.0 110.409 179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.404 HD21 ' HD2' ' A' ' 1' ' ' ARG . 17.9 mt -81.75 -7.09 59.56 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.842 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.443 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 31.7 mm-40 -71.19 118.83 69.39 Favored Pre-proline 0 C--N 1.332 -0.186 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.242 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 10.0 Cg_exo -70.79 150.43 61.93 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 122.5 2.134 . . . . 0.0 112.112 179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 8' ' ' PRO . 2.4 Cg_endo -80.26 -176.97 3.47 Favored 'Trans proline' 0 N--CA 1.46 -0.446 0 C-N-CA 122.744 2.296 . . . . 0.0 111.919 179.817 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 1.3 p90 -153.99 161.46 41.94 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.921 0.391 . . . . 0.0 111.343 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.41 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -134.74 108.4 7.96 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.11 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . 0.454 ' O ' ' HB3' ' A' ' 13' ' ' ALA . . . 172.74 143.94 4.38 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.866 -0.683 . . . . 0.0 112.454 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.454 ' HB3' ' O ' ' A' ' 12' ' ' GLY . . . 70.63 35.06 1.95 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 111.337 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -162.06 165.74 26.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.929 179.428 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.467 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 1.4 tmt_? -159.27 106.06 1.74 Allowed 'General case' 0 C--N 1.331 -0.199 0 N-CA-C 112.007 0.373 . . . . 0.0 112.007 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.467 ' HB3' ' O ' ' A' ' 15' ' ' ARG . . . 71.69 101.36 0.07 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.074 178.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -163.02 44.92 0.13 Allowed 'General case' 0 N--CA 1.446 -0.653 0 CA-C-O 121.37 0.605 . . . . 0.0 110.467 178.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.52 88.98 0.94 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.304 -0.862 . . . . 0.0 111.896 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -162.64 21.7 0.09 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.23 179.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.4 mtt180 -146.13 168.0 22.06 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.595 179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -137.23 173.15 11.99 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.914 0.388 . . . . 0.0 111.117 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.507 ' CE1' ' HB2' ' A' ' 31' ' ' GLN . 25.7 p90 -147.29 155.13 41.77 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.445 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.473 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -86.57 140.0 30.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.902 0.382 . . . . 0.0 110.75 179.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -115.48 90.28 3.3 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.583 179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.18 -29.67 33.14 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.926 0.393 . . . . 0.0 111.119 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 tttt -79.05 -2.02 38.42 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.473 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.65 -1.84 2.01 Favored 'General case' 0 CA--C 1.532 0.271 0 N-CA-C 112.507 0.558 . . . . 0.0 112.507 -179.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.77 -8.6 1.68 Allowed Glycine 0 N--CA 1.446 -0.651 0 C-N-CA 121.053 -0.594 . . . . 0.0 114.542 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -125.69 176.86 6.6 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 117.34 0.57 . . . . 0.0 111.253 -179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 3.1 m -97.34 171.43 8.42 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.335 0.588 . . . . 0.0 111.315 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.507 ' HB2' ' CE1' ' A' ' 22' ' ' PHE . 0.2 OUTLIER -146.54 142.46 28.04 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.212 -0.904 . . . . 0.0 110.601 179.937 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.3 t -75.43 137.9 41.3 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.988 0.423 . . . . 0.0 110.624 179.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.467 ' HB3' ' HB3' ' A' ' 37' ' ' ALA . 47.3 m-85 -53.9 124.1 14.4 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.998 -0.547 . . . . 0.0 111.514 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -74.97 -171.45 1.34 Allowed 'General case' 0 C--O 1.234 0.27 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.067 -179.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -51.36 142.6 13.08 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.795 -0.639 . . . . 0.0 111.878 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 44.8 17.13 0.08 OUTLIER Glycine 0 N--CA 1.44 -1.076 0 CA-C-N 115.556 -0.747 . . . . 0.0 114.92 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.467 ' HB3' ' HB3' ' A' ' 33' ' ' PHE . . . -69.74 -178.97 1.63 Allowed 'General case' 0 C--N 1.332 -0.173 0 CA-C-N 117.746 0.773 . . . . 0.0 110.321 179.042 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.433 ' O ' ' CE1' ' A' ' 33' ' ' PHE . 0.9 OUTLIER -155.17 152.07 28.97 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.124 0.487 . . . . 0.0 111.41 179.713 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.34 139.84 50.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.236 179.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -92.99 -174.32 3.54 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.334 -0.394 . . . . 0.0 111.088 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.77 -80.78 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.691 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.529 ' HB2' ' HB2' ' A' ' 4' ' ' PHE . 8.4 mmt-85 -87.91 -33.77 18.38 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.048 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.21 71.84 2.25 Favored 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 121.12 0.486 . . . . 0.0 110.447 -178.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 40.4 p-10 -156.02 92.99 1.4 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.668 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.523 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 96.3 m-85 -107.01 131.02 54.55 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 179.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -12.03 18.17 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.795 -179.057 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.73 148.95 24.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.921 0.391 . . . . 0.0 111.276 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.24 -36.11 74.88 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.55 -38.57 84.93 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.523 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -66.57 -46.41 76.1 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.286 178.594 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.444 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 2.4 t -60.58 -55.58 31.65 Favored 'General case' 0 C--N 1.339 0.131 0 CA-C-O 121.028 0.442 . . . . 0.0 110.144 179.569 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.407 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 47.7 mt -53.23 -42.54 66.49 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.553 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 5.1 mtp180 -59.7 -51.78 68.3 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.829 0.347 . . . . 0.0 111.147 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 33.0 m -78.66 -58.57 3.18 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.198 -0.455 . . . . 0.0 112.088 -179.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 23.2 m -76.72 -41.15 46.25 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -178.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.407 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -69.0 -77.62 0.38 Allowed Glycine 0 CA--C 1.518 0.24 0 C-N-CA 120.456 -0.878 . . . . 0.0 112.485 -179.564 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -49.64 126.82 21.78 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.544 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.037 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.112 179.952 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.616 0.246 . . . . 0.0 111.15 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_exo -60.98 138.81 81.16 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.287 1.991 . . . . 0.0 112.091 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -44.92 -61.96 1.41 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.823 -0.626 . . . . 0.0 112.403 -178.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.473 ' HB2' ' CB ' ' A' ' 42' ' ' ARG . 20.4 p90 -51.99 -29.83 22.46 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 -178.645 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . . . . . . . . . 78.6 m -61.65 -18.15 58.34 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.088 0.47 . . . . 0.0 110.743 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 15.9 mt -81.44 -12.11 59.02 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.968 179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 31.8 mm-40 -72.42 114.39 29.32 Favored Pre-proline 0 C--N 1.331 -0.232 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.964 179.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' HA ' ' HD3' ' A' ' 9' ' ' PRO . 93.7 Cg_endo -82.45 149.57 14.83 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 122.429 2.086 . . . . 0.0 112.192 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.572 ' HG3' ' CD2' ' A' ' 22' ' ' PHE . 72.9 Cg_endo -94.17 144.78 1.81 Allowed 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 123.034 2.489 . . . . 0.0 112.556 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -87.84 142.37 27.87 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.666 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -118.36 108.36 14.98 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.145 -179.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 124.61 143.3 6.11 Favored Glycine 0 C--N 1.33 0.203 0 C-N-CA 120.837 -0.697 . . . . 0.0 112.554 179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.91 49.26 4.79 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.866 0.365 . . . . 0.0 111.111 179.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 5.7 t -165.16 165.54 19.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.126 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -160.44 81.53 0.68 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.86 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.443 ' O ' ' HB3' ' A' ' 17' ' ' ALA . . . -166.49 149.91 7.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.892 0.377 . . . . 0.0 111.569 -179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . 0.443 ' HB3' ' O ' ' A' ' 16' ' ' ALA . . . 71.04 62.83 0.17 Allowed 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.182 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.76 159.32 34.54 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.301 179.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 32.42 73.41 0.06 Allowed 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.046 -0.525 . . . . 0.0 112.353 179.635 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.455 ' HB2' ' CD2' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -142.96 179.07 7.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.95 0.405 . . . . 0.0 110.918 179.864 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.711 ' CE2' ' HB2' ' A' ' 48' ' ' ALA . 46.2 m-85 -128.97 155.15 45.81 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.132 0.491 . . . . 0.0 111.987 -178.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.572 ' CD2' ' HG3' ' A' ' 9' ' ' PRO . 18.7 p90 -145.7 152.66 39.95 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.317 178.887 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 69.2 t80 -84.73 139.41 32.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.007 0.432 . . . . 0.0 111.512 -179.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.444 ' HB3' ' O ' ' A' ' 29' ' ' LEU . 35.7 t-20 -112.4 88.06 2.73 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.345 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.71 -25.47 18.63 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.227 -179.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.0 mtpp -79.75 -4.77 53.4 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.616 179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -140.3 1.1 1.76 Allowed 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.431 0.53 . . . . 0.0 112.431 -179.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.73 -6.35 2.79 Favored Glycine 0 N--CA 1.447 -0.627 0 N-CA-C 114.826 0.69 . . . . 0.0 114.826 178.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.444 ' O ' ' HB3' ' A' ' 24' ' ' ASN . 2.3 mp -122.33 174.22 7.14 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.395 0.597 . . . . 0.0 111.341 -179.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 22' ' ' PHE . 1.9 m -102.81 168.02 9.5 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.076 0.465 . . . . 0.0 110.936 179.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CE1' ' A' ' 22' ' ' PHE . 23.5 mt-30 -148.39 156.87 43.04 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.617 -0.719 . . . . 0.0 111.609 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.6 t -79.75 147.8 31.73 Favored 'General case' 0 C--N 1.332 -0.162 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.864 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.455 ' CD2' ' HB2' ' A' ' 20' ' ' ARG . 42.0 m-85 -65.49 117.01 7.36 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.016 0.436 . . . . 0.0 111.373 -179.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -73.71 -171.93 1.15 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.055 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -44.42 134.08 5.31 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.782 -179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 39.01 26.02 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 114.842 0.697 . . . . 0.0 114.842 179.077 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.438 ' HB3' ' HB3' ' A' ' 33' ' ' PHE . . . -69.36 168.39 14.47 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 117.207 0.503 . . . . 0.0 110.466 179.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . . . . . . . . . 21.1 m -155.64 145.63 21.5 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.187 0.518 . . . . 0.0 111.911 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.418 ' HB1' ' HB2' ' A' ' 44' ' ' ASN . . . -70.09 174.84 4.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.712 179.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.486 ' O ' ' CB ' ' A' ' 41' ' ' LYS . . . -124.08 34.01 5.15 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.894 0.378 . . . . 0.0 111.387 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.486 ' CB ' ' O ' ' A' ' 40' ' ' ALA . 0.0 OUTLIER 91.19 -68.28 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.281 -0.872 . . . . 0.0 111.487 179.149 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.473 ' CB ' ' HB2' ' A' ' 4' ' ' PHE . 0.8 OUTLIER -88.03 -40.22 14.02 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.82 -178.867 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.26 72.4 2.32 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 121.129 0.49 . . . . 0.0 110.521 -177.642 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.418 ' HB2' ' HB1' ' A' ' 39' ' ' ALA . 16.0 t30 -156.0 93.51 1.45 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.821 -179.18 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.594 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 99.5 m-85 -105.54 130.2 53.65 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 109.938 -0.393 . . . . 0.0 109.938 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 19.8 tttt -63.02 -12.98 29.8 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.293 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -150.35 145.47 26.14 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 120.951 0.405 . . . . 0.0 111.391 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.711 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . . . -60.26 -34.58 73.91 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.965 -0.561 . . . . 0.0 109.596 178.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 0.7 OUTLIER -60.13 -39.2 85.45 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.027 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.2 OUTLIER -65.13 -47.61 76.52 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.438 178.661 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.422 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 3.0 t -60.81 -52.95 62.89 Favored 'General case' 0 C--N 1.339 0.119 0 CA-C-O 120.923 0.392 . . . . 0.0 110.366 179.578 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.4 ' O ' ' CA ' ' A' ' 56' ' ' GLY . 95.5 mt -56.31 -45.12 80.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.485 -179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.41 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -59.23 -45.38 91.29 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.77 0.319 . . . . 0.0 111.097 -179.616 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.4 m -81.05 -62.87 1.54 Allowed 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 16.1 m -85.49 -29.44 24.27 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 112.891 0.7 . . . . 0.0 112.891 -178.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.4 ' CA ' ' O ' ' A' ' 52' ' ' LEU . . . -64.86 -124.38 0.01 OUTLIER Glycine 0 CA--C 1.517 0.179 0 C-N-CA 120.164 -1.017 . . . . 0.0 112.386 -179.583 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 85.23 -59.39 4.86 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.662 -0.78 . . . . 0.0 112.336 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.995 179.78 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 7.6 ptp180 . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 120.373 0.13 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.436 ' HD3' ' HA ' ' A' ' 1' ' ' ARG . 20.8 Cg_exo -60.91 136.53 66.47 Favored 'Trans proline' 0 C--N 1.347 0.471 0 C-N-CA 121.991 1.794 . . . . 0.0 111.717 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -49.11 -56.65 8.45 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 -178.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -52.05 -23.6 5.48 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 112.317 0.488 . . . . 0.0 112.317 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.635 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 70.7 m -62.05 -17.48 57.54 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 120.978 0.418 . . . . 0.0 110.647 179.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.1 mt -82.93 -14.53 53.98 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.231 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -72.63 119.23 74.02 Favored Pre-proline 0 C--N 1.331 -0.202 0 CA-C-N 116.683 -0.235 . . . . 0.0 111.195 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -85.98 156.73 10.01 Favored 'Trans proline' 0 N--CA 1.46 -0.489 0 C-N-CA 122.656 2.237 . . . . 0.0 112.258 179.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.405 ' HG3' ' CD2' ' A' ' 22' ' ' PHE . 91.2 Cg_endo -88.63 -177.84 1.82 Allowed 'Trans proline' 0 N--CA 1.454 -0.805 0 C-N-CA 122.695 2.264 . . . . 0.0 112.029 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.451 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 27.4 p90 -152.94 152.07 31.05 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.914 0.388 . . . . 0.0 111.115 179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -125.48 124.07 40.57 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.337 -179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -178.45 89.08 0.08 OUTLIER Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.975 -0.631 . . . . 0.0 112.189 179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 56.49 94.75 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.852 0.358 . . . . 0.0 111.186 -179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 7.2 m -162.34 171.72 16.78 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.591 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.574 ' O ' ' HB3' ' A' ' 16' ' ' ALA . 0.0 OUTLIER -155.98 171.1 20.68 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.05 -179.722 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' A' ' 15' ' ' ARG . . . 80.03 90.36 0.05 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.446 179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -160.85 64.9 0.3 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.958 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -70.89 82.85 0.65 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.208 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 56.59 92.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.526 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.528 ' O ' ' HA ' ' A' ' 32' ' ' THR . 0.0 OUTLIER -137.47 166.42 23.91 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.434 178.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -136.07 165.48 25.6 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 111.755 -179.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.488 ' O ' ' HA ' ' A' ' 30' ' ' CYS . 12.5 p90 -144.53 153.08 41.46 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.56 178.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.635 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 82.9 t80 -84.43 139.71 32.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.158 0.504 . . . . 0.0 111.707 -178.772 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 29.4 t-20 -115.62 90.15 3.27 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.517 -0.765 . . . . 0.0 110.024 179.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.42 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . . . -52.74 -28.53 22.55 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.8 0.333 . . . . 0.0 111.356 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.93 -1.84 37.14 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.611 179.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -139.69 -3.07 1.5 Allowed 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 112.455 0.539 . . . . 0.0 112.455 -179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.98 -3.73 3.78 Favored Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 114.572 0.589 . . . . 0.0 114.572 179.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -125.57 172.8 9.43 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.231 0.516 . . . . 0.0 111.39 -179.597 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 2.0 m -100.41 170.11 8.64 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.074 0.464 . . . . 0.0 111.485 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.46 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 0.3 OUTLIER -147.99 151.51 35.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.612 -0.722 . . . . 0.0 111.444 -179.942 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.528 ' HA ' ' O ' ' A' ' 20' ' ' ARG . 1.5 t -74.22 147.18 42.71 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-O 120.986 0.422 . . . . 0.0 111.429 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 17.4 m-85 -74.72 131.15 40.62 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.881 -0.599 . . . . 0.0 110.559 179.2 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.459 ' O ' ' N ' ' A' ' 36' ' ' GLY . . . -72.52 157.68 37.15 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 2.0 t80 -66.64 64.13 0.05 OUTLIER 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.205 0.526 . . . . 0.0 110.822 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.459 ' N ' ' O ' ' A' ' 34' ' ' ALA . . . 168.77 -27.95 0.14 Allowed Glycine 0 N--CA 1.429 -1.805 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.362 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.465 ' HA ' ' HA ' ' A' ' 11' ' ' ALA . . . -63.35 129.99 42.6 Favored 'General case' 0 C--O 1.232 0.132 0 CA-C-O 120.932 0.396 . . . . 0.0 111.656 -179.336 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.451 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 13.6 m -83.5 149.62 26.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.976 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.65 164.01 24.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.781 -179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -112.72 168.15 9.9 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.113 179.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 6.7 tttp -63.78 -75.35 0.08 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.593 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 10.3 mmt85 -86.26 -31.9 21.41 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.484 -179.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.45 ' O ' ' HB3' ' A' ' 44' ' ' ASN . 0.5 OUTLIER -73.79 -177.01 2.62 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-O 121.13 0.49 . . . . 0.0 109.955 -178.721 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 43' ' ' ASN . 56.5 t-20 74.0 115.65 0.06 Allowed 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 115.375 -0.83 . . . . 0.0 111.62 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.447 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 64.2 m-85 -119.41 144.48 46.89 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.756 179.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.15 -16.3 59.6 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.621 0.248 . . . . 0.0 111.434 -179.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -151.85 146.21 25.51 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.01 0.433 . . . . 0.0 111.32 179.693 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.51 -39.77 81.03 Favored 'General case' 0 CA--C 1.513 -0.454 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.092 179.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 53' ' ' ARG . 2.0 tt0 -58.68 -39.86 81.93 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 178.294 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.447 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -65.56 -43.22 90.52 Favored 'General case' 0 N--CA 1.455 -0.194 0 CA-C-N 115.437 -0.801 . . . . 0.0 110.398 178.473 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.404 ' O ' ' N ' ' A' ' 55' ' ' CYS . 3.6 t -62.22 -58.19 8.66 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-O 121.16 0.505 . . . . 0.0 109.867 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 34.1 mt -53.76 -44.97 70.45 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.646 -0.706 . . . . 0.0 111.846 179.86 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 49' ' ' GLU . 0.0 OUTLIER -59.36 -50.39 74.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.735 0.303 . . . . 0.0 111.206 -179.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.0 m -78.29 -61.25 2.07 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 112.054 0.391 . . . . 0.0 112.054 -179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.433 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.8 OUTLIER -74.54 -41.37 60.73 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.427 0.528 . . . . 0.0 112.427 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -69.35 -92.89 0.06 OUTLIER Glycine 0 CA--C 1.517 0.218 0 C-N-CA 120.396 -0.907 . . . . 0.0 112.445 -179.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -60.67 90.77 0.05 OUTLIER Glycine 0 N--CA 1.453 -0.217 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.442 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 CA-C-O 118.22 -0.895 . . . . 0.0 111.004 179.925 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.453 ' NE ' HD21 ' A' ' 6' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.556 0.217 . . . . 0.0 111.12 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -52.97 132.77 48.98 Favored 'Trans proline' 0 C--N 1.347 0.455 0 C-N-CA 122.055 1.837 . . . . 0.0 111.768 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -47.74 -51.92 20.42 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -178.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.413 ' CB ' ' HG3' ' A' ' 42' ' ' ARG . 2.8 p90 -52.23 -22.32 4.27 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.887 -0.325 . . . . 0.0 111.837 -178.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.524 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.6 m -57.78 -20.29 34.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.167 0.508 . . . . 0.0 110.428 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.453 HD21 ' NE ' ' A' ' 1' ' ' ARG . 36.5 mt -82.21 -17.55 45.72 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.145 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 28.7 tp10 -75.45 111.43 14.09 Favored Pre-proline 0 CA--C 1.529 0.155 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.454 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 7' ' ' GLU . 36.9 Cg_endo -94.18 158.71 2.12 Favored 'Trans proline' 0 N--CA 1.453 -0.874 0 C-N-CA 122.955 2.436 . . . . 0.0 112.292 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -74.94 -162.74 0.16 Allowed 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 122.627 2.218 . . . . 0.0 112.095 179.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.528 ' CZ ' ' HB3' ' A' ' 38' ' ' CYS . 18.6 p90 -150.21 144.92 25.94 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.991 0.424 . . . . 0.0 111.143 179.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -110.55 115.14 29.1 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.848 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 148.37 138.62 3.05 Favored Glycine 0 C--N 1.328 0.111 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.211 -179.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 61.38 45.4 8.62 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.046 0.451 . . . . 0.0 110.392 -179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.73 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 0.5 OUTLIER -161.86 177.21 10.06 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.041 -179.3 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.411 ' HG3' ' O ' ' A' ' 14' ' ' CYS . 0.0 OUTLIER -147.89 -171.69 3.88 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.009 0.433 . . . . 0.0 111.455 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -70.85 117.84 12.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.486 -179.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -160.6 60.33 0.32 Allowed 'General case' 0 N--CA 1.442 -0.841 0 CA-C-N 115.559 -0.746 . . . . 0.0 110.262 179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.17 137.09 57.78 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.293 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -164.21 -39.67 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.049 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -121.72 -177.79 3.65 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.22 0.533 . . . . 0.0 111.068 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -131.97 166.87 20.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.972 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 28.8 p90 -143.27 152.57 41.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.468 179.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.524 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 78.4 t80 -86.74 143.46 27.54 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.994 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.416 ' HB3' ' HB3' ' A' ' 27' ' ' ALA . 51.9 t-20 -115.01 102.07 9.6 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.621 179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -56.8 -27.0 59.2 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 112.033 0.383 . . . . 0.0 112.033 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.31 -13.63 43.08 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.416 ' HB3' ' HB3' ' A' ' 24' ' ' ASN . . . -115.04 -14.03 11.84 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.62 0.248 . . . . 0.0 111.664 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 74.68 -6.44 25.1 Favored Glycine 0 N--CA 1.439 -1.105 0 C-N-CA 121.066 -0.587 . . . . 0.0 113.721 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.6 mp -127.69 176.61 7.39 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.801 0.334 . . . . 0.0 110.796 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.8 m -101.61 168.17 9.65 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.256 0.551 . . . . 0.0 111.204 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -152.17 145.13 24.46 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.311 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -79.52 145.84 32.98 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.531 178.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.583 ' CE2' ' HA ' ' A' ' 39' ' ' ALA . 78.7 m-85 -58.61 134.47 56.78 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.446 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -164.68 171.89 13.79 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.793 179.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 1.1 t80 54.71 62.54 2.49 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.345 0.593 . . . . 0.0 110.394 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.73 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . 52.4 5.82 0.23 Allowed Glycine 0 N--CA 1.436 -1.332 0 CA-C-N 115.321 -0.854 . . . . 0.0 114.407 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -64.81 126.12 26.96 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 118.076 0.938 . . . . 0.0 111.122 179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.528 ' HB3' ' CZ ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -85.49 174.51 9.44 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.511 -179.809 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.583 ' HA ' ' CE2' ' A' ' 33' ' ' PHE . . . -72.3 129.49 38.54 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.597 179.644 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.0 165.45 24.98 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.435 179.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.7 tttt -62.5 -81.24 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.684 -0.234 . . . . 0.0 111.196 -179.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.413 ' HG3' ' CB ' ' A' ' 4' ' ' PHE . 0.0 OUTLIER -93.77 -24.72 17.69 Favored 'General case' 0 C--N 1.332 -0.153 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -179.325 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.13 79.3 2.27 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 120.95 0.405 . . . . 0.0 110.377 -178.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 7.7 m120 -155.52 105.48 2.45 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.514 -179.153 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.565 ' HE1' HG21 ' A' ' 54' ' ' THR . 86.8 m-85 -103.47 140.53 37.37 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 109.688 -0.486 . . . . 0.0 109.688 178.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.02 -15.3 30.4 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.783 -178.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -165.85 154.33 11.22 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.896 0.379 . . . . 0.0 111.08 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.16 -38.08 75.93 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 178.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 -60.32 -36.71 78.56 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 177.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -67.25 -49.11 65.63 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.562 178.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.467 ' HB2' ' CD2' ' A' ' 45' ' ' PHE . 19.0 t -62.27 -55.63 26.45 Favored 'General case' 0 C--O 1.231 0.087 0 CA-C-O 120.891 0.377 . . . . 0.0 110.558 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.52 ' HA ' ' HA3' ' A' ' 56' ' ' GLY . 79.5 mt -51.77 -52.59 47.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.947 -179.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -57.85 -35.28 70.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.816 0.341 . . . . 0.0 110.77 179.744 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.565 HG21 ' HE1' ' A' ' 45' ' ' PHE . 23.0 m -80.07 -70.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.798 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . . . . . . . . . 13.1 t -96.89 -23.07 16.52 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . 0.52 ' HA3' ' HA ' ' A' ' 52' ' ' LEU . . . -47.67 98.49 0.02 OUTLIER Glycine 0 CA--C 1.518 0.241 0 C-N-CA 120.647 -0.787 . . . . 0.0 112.926 -179.677 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -134.01 -168.56 11.83 Favored Glycine 0 N--CA 1.454 -0.137 0 C-N-CA 120.931 -0.652 . . . . 0.0 112.286 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.015 0 CA-C-O 118.246 -0.883 . . . . 0.0 111.576 -179.829 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.562 0.22 . . . . 0.0 111.075 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.415 ' HB2' ' SG ' ' A' ' 5' ' ' CYS . 16.6 Cg_exo -61.91 135.16 53.95 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.021 1.814 . . . . 0.0 111.888 -180.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -48.19 -58.46 4.5 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . 0.511 ' HB3' ' HB3' ' A' ' 42' ' ' ARG . 8.2 p90 -49.93 -25.07 2.91 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -178.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.649 ' HB3' ' CD2' ' A' ' 23' ' ' TYR . 74.1 m -60.88 -26.18 67.23 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.123 0.487 . . . . 0.0 110.523 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 7.9 mt -83.63 -13.22 54.75 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.92 179.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.49 114.89 33.93 Favored Pre-proline 0 C--N 1.332 -0.16 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.413 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -93.79 153.71 2.3 Favored 'Trans proline' 0 N--CA 1.456 -0.73 0 C-N-CA 123.01 2.474 . . . . 0.0 112.089 179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_endo -78.13 147.26 23.39 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.398 2.065 . . . . 0.0 112.255 179.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.526 ' CZ ' ' CB ' ' A' ' 38' ' ' CYS . 10.4 p90 -84.69 130.01 34.76 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.328 179.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -97.86 88.06 4.18 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.119 -179.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 154.01 152.71 6.16 Favored Glycine 0 N--CA 1.452 -0.246 0 C-N-CA 120.572 -0.823 . . . . 0.0 112.498 -179.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . 58.96 37.48 24.57 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.914 0.388 . . . . 0.0 110.856 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.465 ' HB3' ' O ' ' A' ' 36' ' ' GLY . 48.0 t -162.99 161.52 25.58 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.383 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.61 134.47 8.96 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.893 0.378 . . . . 0.0 111.608 -179.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 67.19 119.14 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.632 179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -161.78 44.7 0.16 Allowed 'General case' 0 N--CA 1.448 -0.572 0 CA-C-O 121.299 0.571 . . . . 0.0 110.839 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -68.72 -169.25 0.15 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.394 -0.821 . . . . 0.0 111.749 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . 47.03 25.52 0.5 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.313 -0.858 . . . . 0.0 112.211 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.456 ' HB2' ' CD1' ' A' ' 33' ' ' PHE . 6.6 mtp85 -142.38 158.42 43.72 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.204 0.526 . . . . 0.0 111.038 179.579 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.591 ' CD2' ' HB2' ' A' ' 48' ' ' ALA . 3.1 m-85 -140.91 172.33 12.84 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.841 -0.618 . . . . 0.0 111.211 -179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 23.9 p90 -150.6 156.28 41.07 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.113 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.649 ' CD2' ' HB3' ' A' ' 5' ' ' CYS . 87.2 t80 -83.42 138.27 33.56 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.072 0.463 . . . . 0.0 110.965 -179.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -105.4 91.39 3.76 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.319 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -53.57 -22.81 9.11 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.61 -179.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -91.19 -1.6 57.68 Favored 'General case' 0 CA--C 1.534 0.327 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.59 -3.6 1.87 Allowed 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.413 ' HA2' ' OH ' ' A' ' 23' ' ' TYR . . . 70.44 -7.73 4.65 Favored Glycine 0 N--CA 1.446 -0.673 0 N-CA-C 114.882 0.713 . . . . 0.0 114.882 178.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.1 mp -123.52 171.37 9.55 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 117.488 0.644 . . . . 0.0 111.674 -179.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 1.4 m -101.68 164.27 11.83 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-O 121.386 0.612 . . . . 0.0 111.196 179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 70.2 mt-30 -149.72 160.92 43.14 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.97 179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.0 t -75.11 156.56 35.89 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.646 179.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.456 ' CD1' ' HB2' ' A' ' 20' ' ' ARG . 76.5 m-85 -72.89 98.68 2.51 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.255 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.452 ' O ' ' O ' ' A' ' 35' ' ' TYR . . . -77.08 164.0 26.12 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.708 179.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.847 ' CE1' ' HB2' ' A' ' 37' ' ' ALA . 19.9 p90 41.56 -169.9 0.0 OUTLIER 'General case' 0 CA--C 1.52 -0.211 0 CA-C-O 121.538 0.685 . . . . 0.0 111.299 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' A' ' 14' ' ' CYS . . . -65.06 28.38 0.11 Allowed Glycine 0 C--N 1.311 -0.819 0 CA-C-N 115.358 -0.837 . . . . 0.0 114.12 -179.502 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.847 ' HB2' ' CE1' ' A' ' 35' ' ' TYR . . . -67.15 128.3 35.87 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 118.449 1.124 . . . . 0.0 110.83 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.526 ' CB ' ' CZ ' ' A' ' 10' ' ' TYR . 0.3 OUTLIER -84.17 165.01 18.79 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.056 0.455 . . . . 0.0 111.468 -179.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.98 136.72 46.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.412 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.861 ' HB3' ' O ' ' A' ' 43' ' ' ASN . . . -69.37 152.93 44.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.865 179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.28 -65.45 0.69 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.722 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.511 ' HB3' ' HB3' ' A' ' 4' ' ' PHE . 5.3 mtp180 -88.8 -54.05 4.33 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 112.439 0.533 . . . . 0.0 112.439 -178.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.861 ' O ' ' HB3' ' A' ' 40' ' ' ALA . 0.0 OUTLIER -84.6 96.94 9.34 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-O 121.571 0.7 . . . . 0.0 111.049 -178.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 2.8 p30 -156.81 95.49 1.53 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.464 -0.789 . . . . 0.0 110.668 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.522 ' HB3' ' HB3' ' A' ' 50' ' ' ASP . 85.0 m-85 -103.76 128.6 51.14 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.78 0.324 . . . . 0.0 110.911 -179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.4 mttt -63.43 -13.49 40.59 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.923 179.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.32 142.41 33.84 Favored 'General case' 0 CA--C 1.516 -0.353 0 CA-C-O 121.017 0.437 . . . . 0.0 111.127 179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.591 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . . . -61.98 -38.17 87.56 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.336 179.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -58.99 -38.62 79.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 178.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.522 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.6 OUTLIER -65.65 -44.05 87.54 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.4 -0.818 . . . . 0.0 110.201 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.451 ' O ' ' N ' ' A' ' 55' ' ' CYS . 2.0 t -61.43 -55.34 32.48 Favored 'General case' 0 C--N 1.339 0.135 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 88.7 mt -53.26 -42.93 66.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.293 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -48.51 79.48 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.864 0.364 . . . . 0.0 110.515 179.804 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.445 ' HG1' ' HE2' ' A' ' 45' ' ' PHE . 8.0 m -80.13 -62.89 1.54 Allowed 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.835 -179.912 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.451 ' N ' ' O ' ' A' ' 51' ' ' CYS . 1.5 m -72.12 -44.69 62.78 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . -55.52 -66.33 2.91 Favored Glycine 0 CA--C 1.518 0.235 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.681 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.552 ' O ' ' HB3' ' A' ' 58' ' ' ALA . . . -62.58 -104.97 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.721 -0.752 . . . . 0.0 112.463 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.552 ' HB3' ' O ' ' A' ' 57' ' ' GLY . . . . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.196 -0.907 . . . . 0.0 111.033 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . 0.63 ' NH2' ' HB1' ' A' ' 25' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 120.664 0.269 . . . . 0.0 111.247 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.479 ' HG2' ' HA ' ' A' ' 55' ' ' CYS . 25.5 Cg_exo -58.14 152.09 54.63 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 122.239 1.959 . . . . 0.0 112.041 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -49.03 -61.31 2.13 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.673 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 4.6 p90 -55.12 -22.98 18.71 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.71 0.291 . . . . 0.0 111.245 -179.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' CYS . . . . . 0.453 ' SG ' ' CD2' ' A' ' 23' ' ' TYR . 0.1 OUTLIER -60.46 -20.05 58.65 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.149 0.5 . . . . 0.0 109.964 179.108 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.5 HD23 ' HE ' ' A' ' 1' ' ' ARG . 16.5 mt -82.13 -17.06 47.75 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.409 178.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -72.35 114.21 27.66 Favored Pre-proline 0 C--N 1.333 -0.15 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.007 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -85.37 156.71 10.88 Favored 'Trans proline' 0 N--CA 1.459 -0.534 0 C-N-CA 122.572 2.182 . . . . 0.0 112.248 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.53 ' HG3' ' CD1' ' A' ' 22' ' ' PHE . 62.7 Cg_endo -85.87 176.15 5.49 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 122.636 2.224 . . . . 0.0 111.408 179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.457 ' CZ ' ' HB2' ' A' ' 38' ' ' CYS . 1.1 p90 -155.74 149.73 25.45 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.095 0.474 . . . . 0.0 111.771 -179.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.58 ' HA ' ' HA ' ' A' ' 37' ' ' ALA . . . -117.62 107.79 14.66 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.183 179.298 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . -145.46 -115.32 0.95 Allowed Glycine 0 N--CA 1.453 -0.189 0 C-N-CA 120.256 -0.973 . . . . 0.0 113.719 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.411 ' O ' ' SG ' ' A' ' 14' ' ' CYS . . . -75.55 77.75 2.57 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 112.266 0.469 . . . . 0.0 112.266 -178.337 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' CYS . . . . . 0.411 ' SG ' ' O ' ' A' ' 13' ' ' ALA . 88.0 m -159.84 179.0 9.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.031 179.123 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 1.7 ttt180 -156.45 104.01 2.17 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.895 0.379 . . . . 0.0 111.525 -179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . 63.03 130.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.532 179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -161.45 45.8 0.18 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.704 179.241 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.42 ' O ' ' HB3' ' A' ' 19' ' ' ALA . . . -68.29 -174.08 0.47 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.206 -179.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 18' ' ' ALA . . . 68.61 16.98 9.03 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.904 -0.589 . . . . 0.0 111.277 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.1 mtp180 -142.85 167.87 21.06 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 121.463 0.649 . . . . 0.0 111.216 179.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.4 ' CZ ' HG23 ' A' ' 32' ' ' THR . 61.6 m-85 -139.65 167.14 22.78 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.156 -179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PHE . . . . . 0.53 ' CD1' ' HG3' ' A' ' 9' ' ' PRO . 13.6 p90 -149.14 146.65 27.78 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.477 178.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.453 ' CD2' ' SG ' ' A' ' 5' ' ' CYS . 83.5 t80 -83.93 132.07 34.8 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.922 179.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 31.7 t-20 -102.23 98.1 8.29 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.502 179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.63 ' HB1' ' NH2' ' A' ' 1' ' ' ARG . . . -53.57 -33.12 53.63 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.385 -179.645 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.3 mttt -83.23 3.35 31.54 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.953 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -137.53 -4.76 1.81 Allowed 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 112.479 0.548 . . . . 0.0 112.479 -179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 67.28 -6.62 2.22 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.886 0.715 . . . . 0.0 114.886 178.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 mp -127.45 171.55 11.47 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 117.524 0.662 . . . . 0.0 111.225 -179.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.513 ' HA ' ' O ' ' A' ' 22' ' ' PHE . 1.6 m -96.35 168.39 10.59 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 121.114 0.483 . . . . 0.0 111.197 -179.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.499 ' HB3' ' CZ ' ' A' ' 22' ' ' PHE . 4.0 tt0 -147.62 152.71 38.34 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.737 -179.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.4 HG23 ' CZ ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -76.62 134.46 39.32 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.821 179.078 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -61.01 166.63 3.39 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 178.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.684 ' H ' ' HB3' ' A' ' 37' ' ' ALA . . . -168.52 -152.32 0.11 Allowed 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.801 -179.165 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.423 ' C ' ' H ' ' A' ' 37' ' ' ALA . 12.9 t80 -39.51 121.69 1.24 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.438 ' O ' ' HA ' ' A' ' 11' ' ' ALA . . . 54.17 -2.92 0.02 OUTLIER Glycine 0 N--CA 1.438 -1.167 0 N-CA-C 115.523 0.969 . . . . 0.0 115.523 178.049 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ALA . . . . . 0.684 ' HB3' ' H ' ' A' ' 34' ' ' ALA . . . -67.44 106.82 2.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.967 0.883 . . . . 0.0 110.881 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.457 ' HB2' ' CZ ' ' A' ' 10' ' ' TYR . 70.8 m -82.82 145.23 29.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.45 -179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -71.14 138.69 49.86 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.226 179.719 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -87.84 164.4 15.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.794 179.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -61.16 -71.73 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.651 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 1.3 mmp_? -86.12 -38.74 17.43 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.068 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -75.62 70.04 2.4 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-O 121.229 0.538 . . . . 0.0 110.306 -178.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -155.77 92.73 1.4 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.165 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.547 ' CG ' ' HA ' ' A' ' 51' ' ' CYS . 81.2 m-85 -106.29 134.47 49.37 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.847 0.356 . . . . 0.0 110.662 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -13.75 25.19 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 0.0 112.021 -179.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -155.66 150.84 26.75 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.792 0.329 . . . . 0.0 111.095 -179.735 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -58.37 -38.98 78.37 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 179.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.32 -37.88 81.97 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . 0.506 ' HB3' ' HB3' ' A' ' 45' ' ' PHE . 0.4 OUTLIER -67.22 -42.98 83.14 Favored 'General case' 0 N--CA 1.454 -0.269 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.288 178.597 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.547 ' HA ' ' CG ' ' A' ' 45' ' ' PHE . 5.3 t -63.83 -59.76 4.13 Favored 'General case' 0 C--N 1.339 0.128 0 CA-C-O 121.159 0.504 . . . . 0.0 109.815 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 24.7 mt -52.64 -42.28 64.53 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.436 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 3.8 mmt180 -59.16 -51.69 68.91 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.825 0.345 . . . . 0.0 111.181 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.404 ' HB ' ' CE1' ' A' ' 45' ' ' PHE . 2.0 m -79.96 -59.92 2.54 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.467 -179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' CYS . . . . . 0.479 ' HA ' ' HG2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER -69.63 -47.77 62.27 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.866 -178.846 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLY . . . . . . . . . . . . . . . 45.72 -167.84 0.04 OUTLIER Glycine 0 CA--C 1.518 0.268 0 C-N-CA 120.833 -0.699 . . . . 0.0 112.582 -179.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.421 ' O ' ' HB3' ' A' ' 58' ' ' ALA . . . -175.79 -179.67 46.43 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.573 -0.822 . . . . 0.0 112.774 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ALA . . . . . 0.421 ' HB3' ' O ' ' A' ' 57' ' ' GLY . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.224 -0.894 . . . . 0.0 111.144 179.953 . . . . . . . . 1 1 . 1 stop_ save_