data_1m9o_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 1m9o _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 ' 11' ' ' LYS . . . . . 0.48 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.444 -0.735 0 CA-C-O 121.302 0.572 . . . . 0.0 111.266 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.0 t -119.87 1.0 10.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.191 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -81.57 -173.74 4.57 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.384 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.591 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -161.12 147.92 14.94 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.857 -179.362 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.604 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 18.8 t -72.34 85.9 1.11 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.591 ' HG3' HD23 ' A' ' 14' ' ' LEU . 1.1 mtp85 -78.07 -101.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -71.66 -21.48 61.81 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.737 0.78 . . . . 0.0 110.047 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.592 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -52.99 -48.07 67.76 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.493 -1.231 . . . . 0.0 112.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.12 -12.8 0.09 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.843 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.39 32.96 2.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.473 0.654 . . . . 0.0 110.6 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 70.02 15.11 7.78 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.689 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.0 -88.62 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.954 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.421 ' HE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -114.93 -64.45 1.31 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.843 0.83 . . . . 0.0 112.153 -178.725 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.713 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.17 83.97 0.16 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.711 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.57 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 16.2 tpt85 -55.36 -14.1 1.72 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.439 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.638 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 20.7 m-85 -139.2 51.91 1.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -38.4 118.81 0.76 Allowed Glycine 0 CA--C 1.52 0.401 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.943 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 75.7 -14.97 0.73 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.736 0.414 . . . . 0.0 111.967 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.474 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -124.94 17.09 8.57 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.273 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.638 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 27.3 p -84.3 132.59 34.6 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.418 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -131.17 -17.36 3.05 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.65 -1.613 . . . . 0.0 110.38 178.827 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.48 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 82.8 m-85 -157.75 -85.79 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.597 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -33.26 105.57 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -177.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.713 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -161.99 -139.67 0.05 Allowed 'General case' 0 CA--C 1.557 1.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 -179.325 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -50.68 -113.53 0.01 OUTLIER Glycine 0 C--N 1.348 1.218 0 CA-C-N 118.118 0.417 . . . . 0.0 114.015 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.14 -75.19 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.96 0.409 . . . . 0.0 111.436 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.447 -0.582 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.864 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.463 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.459 0 CA-C-O 120.956 0.407 . . . . 0.0 110.965 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.9 t -127.84 2.61 6.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.208 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.644 ' CG ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -86.67 -174.03 4.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.454 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.68 HD13 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -169.01 156.51 7.32 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.554 0.692 . . . . 0.0 112.571 -179.201 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.648 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 5.1 t -71.17 84.02 0.73 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.692 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.615 ' HG2' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -70.04 -97.71 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.822 0.344 . . . . 0.0 111.504 -179.109 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -81.59 -19.82 41.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 122.055 0.931 . . . . 0.0 110.171 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.709 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -50.61 -51.12 51.61 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.388 -1.278 . . . . 0.0 112.567 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.11 -32.29 22.16 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.458 ' O ' ' CB ' ' A' ' 21' ' ' SER . 3.7 tt0 -68.16 -40.89 82.21 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.113 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 0.4 OUTLIER 158.64 18.63 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.93 -90.76 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 121.386 -0.435 . . . . 0.0 113.735 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.443 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 1.3 ttt180 -133.36 -57.15 0.9 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.123 0.963 . . . . 0.0 112.272 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.688 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 72.46 79.85 0.15 Allowed 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.369 -1.741 . . . . 0.0 108.531 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 12.0 tpt180 -50.96 -16.91 0.49 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.441 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 30' ' ' CYS . 18.1 m-85 -140.91 49.9 1.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.441 ' O ' ' HB1' ' A' ' 28' ' ' ALA . . . -37.83 126.02 1.42 Allowed Glycine 0 C--N 1.335 0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.212 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.441 ' HB1' ' O ' ' A' ' 27' ' ' GLY . . . 70.96 -14.35 0.45 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.14 -0.53 . . . . 0.0 112.219 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.419 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -127.85 17.58 6.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 122.688 0.395 . . . . 0.0 111.299 -179.542 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' TYR . 26.6 p -87.37 107.28 18.46 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.507 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -103.67 -16.86 15.35 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.046 176.283 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.507 ' N ' ' OE1' ' A' ' 31' ' ' GLN . 97.6 m-85 -153.71 -138.79 0.08 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.793 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.662 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 51.75 -158.94 0.11 Allowed 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.334 -0.229 . . . . 0.0 111.093 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.709 ' HA ' ' CE2' ' A' ' 18' ' ' TYR . 0.3 OUTLIER 83.59 -147.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 178.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.43 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -61.39 -132.42 0.01 OUTLIER Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.262 0.465 . . . . 0.0 114.262 -178.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -37.22 -77.12 0.02 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.656 -0.772 . . . . 0.0 111.502 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.68 ' HA2' HD13 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 121.275 -0.488 . . . . 0.0 113.937 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.411 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.444 -0.747 0 CA-C-O 121.06 0.457 . . . . 0.0 110.765 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -121.67 -3.92 9.25 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.447 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.762 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -79.91 -170.45 2.44 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.544 ' O ' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -166.06 144.84 5.88 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.337 0.589 . . . . 0.0 111.899 -179.089 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.622 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -71.16 84.73 0.74 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.537 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.438 ' CD ' HD11 ' A' ' 36' ' ' LEU . 3.8 mtp180 -79.48 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -71.34 -18.91 62.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.548 0.689 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.692 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.8 m-85 -53.55 -48.08 69.44 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.943 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.52 -36.77 7.07 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.18 0.514 . . . . 0.0 111.747 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.526 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.6 tt0 -67.73 -38.17 83.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 14.4 t 150.53 -0.72 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.718 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -43.25 -41.11 4.85 Favored Glycine 0 C--N 1.332 0.342 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -178.26 -60.27 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.463 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.73 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 67.26 80.78 0.21 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.661 -176.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.59 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 3.9 tpp180 -52.52 -18.72 1.84 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.674 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.678 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 23.6 m-85 -137.09 49.76 2.02 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.512 ' O ' ' HB1' ' A' ' 28' ' ' ALA . . . -37.09 122.22 0.85 Allowed Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.199 -0.524 . . . . 0.0 114.08 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.512 ' HB1' ' O ' ' A' ' 27' ' ' GLY . . . 78.21 -25.81 0.19 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.643 0.777 . . . . 0.0 112.333 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -115.25 8.52 15.52 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.474 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.678 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 21.8 p -72.09 131.48 42.9 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.422 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -127.57 -17.73 4.53 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.299 179.202 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.533 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 91.0 m-85 -158.62 -84.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.689 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -33.26 107.12 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.73 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.27 -116.16 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.589 178.534 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.442 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -55.04 -103.22 0.01 OUTLIER Glycine 0 C--N 1.354 1.582 0 O-C-N 122.43 -0.169 . . . . 0.0 113.401 -178.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.438 HD11 ' CD ' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -100.45 -58.09 1.98 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.762 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.442 -0.962 0 CA-C-N 115.377 -0.829 . . . . 0.0 113.749 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.017 0.437 . . . . 0.0 111.628 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.464 ' O ' ' OG1' ' A' ' 12' ' ' THR . 0.6 OUTLIER -129.55 41.12 3.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.125 -178.268 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.58 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.2 mt-10 -132.2 -168.36 2.03 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.516 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -164.21 142.05 7.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.148 0.499 . . . . 0.0 111.597 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.577 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.6 t -66.97 79.26 0.12 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.842 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.493 ' HG3' HD22 ' A' ' 14' ' ' LEU . 6.5 mtp85 -72.26 -97.96 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.626 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -74.59 -23.47 58.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.87 0.843 . . . . 0.0 109.958 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.6 m-85 -49.91 -48.58 51.6 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.456 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.56 -37.59 63.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.476 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.5 tt0 -58.43 -44.62 89.21 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 1.9 p 154.12 28.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.678 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.24 -95.15 0.08 OUTLIER Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.278 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.411 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -121.02 -54.01 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 122.05 0.929 . . . . 0.0 111.925 -178.586 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.733 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 64.05 78.96 0.27 Allowed 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.388 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -47.39 -21.51 0.32 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.443 -178.217 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.643 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 25.9 m-85 -133.45 47.68 2.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -38.11 120.76 0.94 Allowed Glycine 0 C--N 1.332 0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 114.109 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 81.51 -23.23 0.23 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.098 0.559 . . . . 0.0 112.221 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.51 19.51 9.61 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.245 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.643 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.7 p -84.43 127.48 34.04 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -176.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -123.16 -22.16 5.23 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.22 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.487 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 97.5 m-85 -160.54 -165.37 1.41 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.288 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.594 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 49.14 100.84 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.111 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.733 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -164.23 -109.81 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.092 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.423 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -75.66 -118.8 0.12 Allowed Glycine 0 C--N 1.349 1.252 0 CA-C-O 121.089 0.272 . . . . 0.0 113.024 -179.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -78.69 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.757 0.313 . . . . 0.0 111.202 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.58 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 C--N 1.333 0.389 0 CA-C-O 121.371 0.429 . . . . 0.0 113.972 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 mttt . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 121.198 0.523 . . . . 0.0 112.143 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.6 t -129.01 37.32 4.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.932 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.616 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.2 mt-10 -118.67 -174.37 2.67 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.447 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.858 HD12 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -157.09 150.75 24.38 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.872 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.578 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -74.92 88.09 2.32 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.373 178.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.524 ' HG3' HD22 ' A' ' 14' ' ' LEU . 16.5 mtp180 -77.13 -99.88 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.2 t -73.06 -23.44 60.57 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.852 0.834 . . . . 0.0 110.061 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -49.54 -50.34 42.46 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.746 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 38.4 p -46.01 -15.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.268 -0.878 . . . . 0.0 113.353 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.1 OUTLIER -98.64 35.14 1.88 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.538 0.685 . . . . 0.0 110.961 -179.512 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 4.2 m 68.6 17.4 8.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.519 -1.218 . . . . 0.0 112.072 178.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.3 -88.25 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.25 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.44 -62.18 1.63 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.874 0.845 . . . . 0.0 111.563 -178.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.687 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.8 m 61.38 80.12 0.23 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.605 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.431 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -49.22 -21.47 0.8 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.037 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.556 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 19.6 m-85 -135.88 48.06 2.22 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -37.76 121.45 0.94 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 121.266 -0.492 . . . . 0.0 114.156 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 80.74 -25.55 0.17 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.239 0.615 . . . . 0.0 112.438 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -116.77 7.92 13.54 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.546 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.556 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.5 p -71.12 132.84 45.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.127 0.965 . . . . 0.0 113.557 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.74 -17.3 2.52 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 113.522 -1.672 . . . . 0.0 110.211 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.416 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 89.6 m-85 -157.98 -80.69 0.06 Allowed 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.659 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -40.41 109.72 0.12 Allowed 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.855 -177.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.687 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -169.51 -145.5 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.546 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.448 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -66.76 99.2 0.46 Allowed Glycine 0 C--N 1.345 1.06 0 O-C-N 122.042 -0.411 . . . . 0.0 112.3 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.403 ' O ' ' O ' ' A' ' 35' ' ' GLY . 2.5 tt 54.9 169.13 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.298 0.57 . . . . 0.0 110.246 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.858 ' HA2' HD12 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.431 -1.693 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.435 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.3 OUTLIER . . . . . 0 N--CA 1.449 -0.484 0 CA-C-O 121.281 0.563 . . . . 0.0 112.098 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 37' ' ' GLY . 5.6 t -128.12 36.69 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.679 -178.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.504 ' HB3' ' O ' ' A' ' 32' ' ' PHE . 0.6 OUTLIER -121.46 -170.09 1.97 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.15 -179.329 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.76 ' O ' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -164.25 143.91 7.75 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.022 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.61 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 17.7 t -64.87 84.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.469 ' CZ ' ' HG ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.83 -100.88 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.675 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 t -69.69 -25.99 64.15 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.935 0.874 . . . . 0.0 109.913 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.1 m-85 -50.17 -53.04 30.5 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.309 -1.314 . . . . 0.0 111.238 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -46.67 -12.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.166 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.21 31.05 2.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.407 0.622 . . . . 0.0 110.667 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m 69.4 21.18 7.02 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.024 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.66 -92.75 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.059 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -64.18 1.2 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.917 0.865 . . . . 0.0 111.52 -179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.738 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.3 m 62.28 79.85 0.24 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.435 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.602 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 27.2 tpt180 -47.96 -20.31 0.32 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.12 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.665 ' HB2' ' CA ' ' A' ' 30' ' ' CYS . 17.8 m-85 -140.83 57.59 1.56 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.738 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -37.02 -35.08 0.12 Allowed Glycine 0 N--CA 1.465 0.601 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 -177.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.96 -16.66 13.06 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.321 1.06 . . . . 0.0 111.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 25.52 7.42 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.665 ' CA ' ' HB2' ' A' ' 26' ' ' TYR . 30.2 p -81.62 129.13 34.58 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.71 -15.4 2.09 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.589 -1.642 . . . . 0.0 110.253 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.504 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 81.2 m-85 -157.66 -82.33 0.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.602 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . -37.75 102.98 0.03 OUTLIER 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.522 -177.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.682 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.93 -138.51 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.451 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.483 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -67.71 -163.95 2.4 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 118.312 0.505 . . . . 0.0 112.283 178.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.485 ' O ' HD23 ' A' ' 14' ' ' LEU . 7.8 tt -44.95 117.01 1.2 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.106 0.479 . . . . 0.0 110.321 179.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.654 ' HA3' HD22 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.44 -1.036 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HB2' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.365 0.602 . . . . 0.0 112.103 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' O ' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -112.07 -26.66 8.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.968 -1.014 . . . . 0.0 112.795 -178.359 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.754 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -79.49 -175.41 4.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.417 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.775 HD11 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -167.86 152.0 6.37 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.47 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.63 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.5 t -70.31 84.07 0.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.997 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.435 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.35 -100.2 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.1 t -72.38 -23.21 61.08 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.736 0.779 . . . . 0.0 110.432 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.59 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -52.52 -45.34 66.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.876 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -49.77 -11.08 0.05 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.734 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.41 ' H ' ' C ' ' A' ' 18' ' ' TYR . 3.0 mt-10 -96.73 33.73 1.8 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.583 0.706 . . . . 0.0 110.324 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.6 m 66.91 18.7 10.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.668 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.31 -92.72 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.856 -0.688 . . . . 0.0 113.157 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.405 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -109.89 -64.12 1.29 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.783 0.801 . . . . 0.0 112.179 -178.799 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.687 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 65.73 81.95 0.19 Allowed 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.561 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.556 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -51.07 -19.1 0.98 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.188 -178.42 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' CYS . 23.5 m-85 -141.23 46.44 1.73 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.429 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -38.26 127.91 1.68 Allowed Glycine 0 C--N 1.334 0.47 0 CA-C-N 116.009 -0.542 . . . . 0.0 113.915 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 77.22 -23.88 0.24 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.01 0.433 . . . . 0.0 111.713 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.5 OUTLIER -124.01 19.72 9.18 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.885 -179.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.0 p -89.1 113.37 24.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -176.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.42 ' C ' ' CD1' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -110.46 -19.35 12.97 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.112 176.413 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.643 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 91.8 m-85 -160.69 -153.69 0.33 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.376 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.556 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 40.91 95.91 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.052 0.141 . . . . 0.0 111.092 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.687 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.66 -136.19 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -178.896 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.413 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -62.38 -104.05 0.01 OUTLIER Glycine 0 C--N 1.352 1.445 0 CA-C-N 118.672 0.669 . . . . 0.0 112.307 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -130.21 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 178.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.775 ' HA2' HD11 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.437 -1.275 0 C-N-CA 120.299 -0.953 . . . . 0.0 114.726 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.524 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.711 0 CA-C-O 121.167 0.508 . . . . 0.0 111.044 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.1 t -117.79 -7.58 10.95 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.32 -178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.757 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -79.72 -175.51 4.89 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.281 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.504 HD12 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -163.24 150.31 12.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.399 -178.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.582 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 8.6 t -71.96 81.66 0.93 Allowed 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.473 ' HG3' HD21 ' A' ' 14' ' ' LEU . 40.7 mtt-85 -75.69 -99.53 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.638 -179.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -74.75 -21.3 59.42 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.556 0.693 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.617 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -54.14 -45.48 71.98 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.653 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.73 -17.66 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.673 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.67 35.71 2.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.645 0.736 . . . . 0.0 110.175 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 m 69.0 12.39 8.6 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.415 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.557 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -63.01 -17.17 58.42 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.935 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.557 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 171.24 -68.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.713 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 4.0 m 64.3 83.83 0.16 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.358 -178.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 11.9 tpt180 -55.73 -13.75 1.88 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.931 -1.031 . . . . 0.0 112.104 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.675 ' CE2' ' HB1' ' A' ' 33' ' ' ALA . 20.3 m-85 -139.74 52.6 1.7 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.71 121.01 0.88 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 113.694 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 71.82 -17.12 0.36 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.97 0.508 . . . . 0.0 112.055 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -120.46 19.75 11.97 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.278 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.567 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.1 p -87.0 131.75 33.99 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.411 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.9 OUTLIER -128.1 -20.91 3.7 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.72 178.61 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.545 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 78.9 m-85 -155.71 -87.93 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.675 ' HB1' ' CE2' ' A' ' 26' ' ' TYR . . . -28.88 102.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.713 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -160.39 -137.29 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.653 -179.711 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.558 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -46.11 -103.53 0.01 OUTLIER Glycine 0 C--N 1.344 1.013 0 O-C-N 121.861 -0.524 . . . . 0.0 113.621 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.41 ' O ' ' CG ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -89.03 -92.53 0.12 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.523 -0.338 . . . . 0.0 110.435 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.757 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 114.552 0.581 . . . . 0.0 114.552 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.464 0 CA-C-O 121.192 0.52 . . . . 0.0 111.852 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.9 t -125.09 41.35 3.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.745 -178.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -131.7 -168.0 1.96 Allowed 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.52 ' N ' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -163.86 145.95 9.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.196 0.522 . . . . 0.0 111.787 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.606 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 24.6 t -71.55 81.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.243 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.501 ' HG3' HD22 ' A' ' 14' ' ' LEU . 9.7 mtp180 -75.44 -97.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -178.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.436 HG22 ' HD1' ' A' ' 18' ' ' TYR . 8.8 t -73.98 -20.86 60.21 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 121.706 0.765 . . . . 0.0 110.493 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.631 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.0 m-85 -52.93 -44.38 66.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.936 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 93.2 p -47.47 -18.21 0.12 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.381 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.16 33.01 2.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.583 0.706 . . . . 0.0 110.443 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.1 t 67.0 17.15 10.48 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.875 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.54 -25.95 69.24 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.887 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.08 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.747 0.784 . . . . 0.0 112.255 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.696 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 2.8 m 57.51 84.5 0.1 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.721 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.532 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.5 tpp180 -53.41 -17.02 1.64 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.849 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.624 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 23.0 m-85 -136.52 47.55 2.18 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -37.72 119.96 0.77 Allowed Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.898 -0.592 . . . . 0.0 114.115 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 82.5 -27.78 0.12 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.981 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -118.67 21.2 12.64 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.242 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.624 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 32.0 p -86.5 127.18 34.85 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -176.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.88 -20.62 5.35 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.968 -1.469 . . . . 0.0 109.676 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.416 ' HB3' ' HB2' ' A' ' 11' ' ' LYS . 97.1 m-85 -160.87 -160.89 0.78 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.899 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.532 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 45.07 95.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.633 178.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.696 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -159.44 -116.04 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.876 179.418 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.467 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -64.64 -119.8 0.01 OUTLIER Glycine 0 C--N 1.35 1.328 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.9 tp -69.45 -74.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.446 -0.644 0 CA-C-N 115.891 -0.595 . . . . 0.0 114.084 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 mttp . . . . . 0 N--CA 1.445 -0.695 0 CA-C-O 121.168 0.509 . . . . 0.0 112.051 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 t -127.78 44.46 2.93 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.465 -179.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.595 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.1 mt-10 -126.92 177.54 6.55 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.201 -178.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.536 HD22 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -154.03 153.58 32.18 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.569 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 16.2 t -75.41 83.48 2.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.376 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.536 ' HG3' HD22 ' A' ' 14' ' ' LEU . 17.5 mtp180 -77.04 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.708 0.29 . . . . 0.0 111.768 -178.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -70.8 -21.27 62.49 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.49 0.662 . . . . 0.0 110.337 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.614 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -54.22 -47.91 71.65 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.656 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.2 -15.12 0.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.192 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.23 31.05 1.77 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.532 0.682 . . . . 0.0 110.67 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 m 71.41 18.29 5.57 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.955 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.64 -91.15 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.929 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.434 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -115.42 -60.86 1.82 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.052 0.93 . . . . 0.0 112.198 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.695 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 64.9 83.89 0.16 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.104 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.54 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 10.8 tpt180 -53.95 -16.85 2.08 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.698 -178.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.609 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.0 m-85 -138.16 51.25 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 28' ' ' ALA . . . -37.89 123.61 1.22 Allowed Glycine 0 CA--C 1.517 0.204 0 CA-C-N 115.91 -0.586 . . . . 0.0 113.492 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.448 ' HB2' ' O ' ' A' ' 27' ' ' GLY . . . 74.16 -19.52 0.35 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.172 0.589 . . . . 0.0 112.405 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.425 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -122.68 16.49 10.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.16 -179.528 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.609 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.0 p -80.54 131.45 35.54 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 122.169 0.985 . . . . 0.0 113.559 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.428 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -130.96 -16.96 3.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.252 179.347 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.428 ' CD1' ' O ' ' A' ' 31' ' ' GLN . 88.1 m-85 -158.06 -85.0 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.701 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -34.43 109.01 0.07 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.082 -177.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.701 ' ND1' ' O ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -165.52 -134.08 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 O-C-N 123.259 0.349 . . . . 0.0 110.388 -179.425 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.451 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -50.7 -111.05 0.01 OUTLIER Glycine 0 C--N 1.355 1.59 0 CA-C-N 118.58 0.627 . . . . 0.0 113.027 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.491 HD21 HH11 ' A' ' 16' ' ' ARG . 1.8 tp -75.38 -82.95 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.595 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.442 -0.901 0 C-N-CA 121.036 -0.602 . . . . 0.0 113.362 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.443 -0.79 0 CA-C-O 121.149 0.5 . . . . 0.0 111.515 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 t -119.87 13.99 12.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.583 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.558 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.9 mt-10 -96.53 -168.4 1.72 Allowed 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -178.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -168.99 153.54 5.67 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.441 0.639 . . . . 0.0 112.221 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.601 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.1 t -73.28 82.0 1.36 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.329 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.531 ' HG3' ' CD2' ' A' ' 14' ' ' LEU . 4.2 mtp85 -72.67 -98.47 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -178.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -75.4 -23.61 57.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.845 0.831 . . . . 0.0 110.086 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.594 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.1 -47.04 54.0 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.819 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.62 -11.31 0.05 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.834 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' ' 18' ' ' TYR . 1.3 mt-10 -97.6 33.03 2.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.585 0.707 . . . . 0.0 110.529 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.05 16.51 8.67 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.703 179.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -91.31 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.98 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.515 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -111.05 -63.96 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.957 0.884 . . . . 0.0 111.543 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.693 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 64.33 83.01 0.17 Allowed 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.98 -1.464 . . . . 0.0 109.382 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.515 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 2.2 tpt85 -50.92 -20.41 1.32 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.736 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.589 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 21.6 m-85 -142.39 55.92 1.44 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.674 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.85 -32.75 0.07 OUTLIER Glycine 0 N--CA 1.464 0.523 0 N-CA-C 115.677 1.031 . . . . 0.0 115.677 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.3 -17.04 13.25 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 118.337 1.068 . . . . 0.0 111.694 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.419 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.6 OUTLIER -126.08 25.9 6.63 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.226 -178.391 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.589 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 30.3 p -82.14 126.26 31.83 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.219 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -14.91 3.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.57 -1.65 . . . . 0.0 110.12 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.456 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 93.9 m-85 -158.83 -82.12 0.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.19 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.698 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -35.33 108.53 0.07 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.827 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.698 ' ND1' ' O ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -168.74 -136.74 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.05 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.456 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -50.52 -112.08 0.01 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.365 0.53 . . . . 0.0 113.469 179.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -81.86 0.08 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.769 0.318 . . . . 0.0 110.271 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.558 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.445 -0.753 0 C-N-CA 121.307 -0.473 . . . . 0.0 113.677 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 121.184 0.516 . . . . 0.0 111.558 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.1 t -137.11 31.64 2.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.775 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.614 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.6 OUTLIER -123.25 -170.49 2.12 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.686 -178.605 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.772 HD22 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -169.47 157.59 7.39 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.067 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.635 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.3 t -75.31 83.08 2.43 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.347 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.772 ' HG2' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -74.98 -99.58 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.476 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 t -75.71 -22.93 56.14 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.89 0.852 . . . . 0.0 109.991 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.642 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -51.67 -45.37 63.39 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.05 -1.432 . . . . 0.0 111.735 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.0 t -49.2 -16.9 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.292 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -100.91 34.39 2.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.601 0.715 . . . . 0.0 110.502 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 15.58 10.15 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.081 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.569 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.19 -17.36 70.01 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 121.128 -0.558 . . . . 0.0 114.082 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.569 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 173.73 -71.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.605 0.717 . . . . 0.0 112.541 -178.975 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.712 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.32 80.39 0.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.653 -178.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 5.7 tpp85 -53.47 -16.94 1.65 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.378 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.557 ' O ' ' N ' ' A' ' 30' ' ' CYS . 20.6 m-85 -142.55 47.61 1.57 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.474 ' O ' ' HB1' ' A' ' 28' ' ' ALA . . . -36.82 128.49 1.09 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.122 -0.561 . . . . 0.0 113.494 -179.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' A' ' 27' ' ' GLY . . . 73.38 -25.22 0.19 Allowed 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.434 ' H ' ' C ' ' A' ' 27' ' ' GLY . 9.1 ttpt -115.41 5.28 14.51 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.557 ' N ' ' O ' ' A' ' 26' ' ' TYR . 7.4 p -69.95 124.19 23.41 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -177.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.462 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -115.75 -22.34 9.19 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.398 -1.273 . . . . 0.0 109.408 178.895 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.462 ' CD1' ' O ' ' A' ' 31' ' ' GLN . 89.9 m-85 -159.97 -84.74 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.019 -179.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.623 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -27.03 104.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.398 0.679 . . . . 0.0 112.688 -178.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.712 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.56 -138.75 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.045 -179.704 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.555 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -44.15 -94.6 0.01 OUTLIER Glycine 0 C--N 1.346 1.131 0 CA-C-N 118.151 0.432 . . . . 0.0 113.636 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -104.13 -85.68 0.46 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.542 . . . . 0.0 110.901 -178.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.753 ' CA ' HD21 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.44 -1.073 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.041 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.169 0.509 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.2 t -130.86 44.24 2.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.326 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.586 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.7 OUTLIER -121.98 -174.53 2.9 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.965 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.757 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -158.32 132.18 7.81 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.475 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.65 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 49.1 t -64.73 87.85 0.06 Allowed 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.727 ' HG3' HD21 ' A' ' 14' ' ' LEU . 32.5 mtp180 -83.91 -103.73 0.05 OUTLIER 'General case' 0 C--N 1.347 0.464 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -66.06 -23.54 66.55 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.932 0.872 . . . . 0.0 109.98 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.54 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.4 m-85 -51.81 -50.23 61.21 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.068 -1.424 . . . . 0.0 112.285 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.542 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 20.5 p -55.4 -35.43 65.32 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.772 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.7 tt0 -62.81 -41.23 99.21 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.976 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 13.2 p 152.94 13.52 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.203 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.12 -91.97 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.421 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.486 ' HE ' ' HD3' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -120.43 -63.08 1.39 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.971 0.891 . . . . 0.0 112.653 -178.046 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.72 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 70.64 79.67 0.17 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.154 -1.385 . . . . 0.0 108.698 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -54.4 -12.08 0.63 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.499 -178.635 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.559 ' CE2' ' HB1' ' A' ' 33' ' ' ALA . 12.3 m-85 -142.84 51.07 1.42 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -38.42 118.15 0.69 Allowed Glycine 0 CA--C 1.521 0.42 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.921 -178.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 79.98 -23.17 0.25 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.405 ' N ' ' O ' ' A' ' 26' ' ' TYR . 9.6 ttpt -118.27 13.69 13.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 14.3 p -77.73 130.77 37.17 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -176.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.03 -19.06 4.47 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.129 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.484 ' O ' ' HB2' ' A' ' 34' ' ' HIS . 94.1 m-85 -158.79 -85.64 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.448 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.59 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -28.42 101.18 0.02 OUTLIER 'General case' 0 C--N 1.35 0.604 0 O-C-N 123.239 0.337 . . . . 0.0 110.987 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.72 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -167.05 -156.72 0.22 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.147 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.46 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -44.96 110.64 0.43 Allowed Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 116.481 -0.327 . . . . 0.0 113.231 178.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 54.05 -92.13 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.541 -0.063 . . . . 0.0 111.075 179.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.633 ' HA2' HD23 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.445 -0.715 0 CA-C-O 121.482 0.49 . . . . 0.0 113.905 178.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.6 mttp . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.365 0.602 . . . . 0.0 111.588 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.6 t -122.98 3.98 9.36 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.956 -178.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.65 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 0.6 OUTLIER -87.46 179.26 6.6 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.455 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.736 HD23 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -159.87 164.98 33.12 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 121.271 0.558 . . . . 0.0 111.929 -179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.586 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 37.6 t -86.82 80.47 8.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.136 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.549 ' HG2' HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -74.6 -101.84 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.565 HG21 ' HD1' ' A' ' 18' ' ' TYR . 9.7 t -66.9 -19.05 65.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.44 0.638 . . . . 0.0 110.052 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.687 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -60.3 -46.5 89.66 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.415 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -14.46 0.19 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.538 -179.191 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.17 32.97 2.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.482 0.658 . . . . 0.0 110.287 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.56 16.11 8.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.983 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.15 -91.03 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.704 -0.76 . . . . 0.0 113.095 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.63 -60.13 1.91 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.627 0.727 . . . . 0.0 111.928 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.732 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 63.64 77.76 0.31 Allowed 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.383 -1.28 . . . . 0.0 108.611 -178.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.422 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 3.5 tpt180 -49.81 -22.99 1.63 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.267 -178.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.564 ' O ' ' N ' ' A' ' 30' ' ' CYS . 21.1 m-85 -137.16 48.22 2.08 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.458 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.6 125.66 1.3 Allowed Glycine 0 CA--C 1.519 0.297 0 CA-C-N 115.896 -0.593 . . . . 0.0 114.197 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.458 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.06 -23.54 0.24 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 111.944 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -117.37 5.58 12.58 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.291 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 26' ' ' TYR . 16.8 p -71.48 125.08 26.11 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.658 0.742 . . . . 0.0 112.555 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.417 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -119.51 -18.49 8.45 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.829 179.566 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.444 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.9 m-85 -159.55 -79.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.978 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.637 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -37.88 110.91 0.14 Allowed 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.732 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.47 -121.1 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.069 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.421 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -56.09 -102.77 0.01 OUTLIER Glycine 0 C--N 1.356 1.661 0 O-C-N 122.011 -0.431 . . . . 0.0 113.255 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.493 HD13 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -94.15 -54.92 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.037 0.446 . . . . 0.0 110.275 179.863 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.736 ' HA2' HD23 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.445 -0.75 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.653 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.434 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 121.135 0.493 . . . . 0.0 111.941 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.2 t -119.36 -2.47 10.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.836 -178.73 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.581 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -80.35 -168.88 1.85 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.913 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -165.86 151.99 9.34 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.34 0.591 . . . . 0.0 112.339 -178.451 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.694 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 7.8 t -70.31 83.15 0.55 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.257 178.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.434 ' HG2' HD22 ' A' ' 14' ' ' LEU . 2.9 mmm-85 -77.29 -101.69 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 t -69.92 -23.32 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.771 0.796 . . . . 0.0 110.271 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.737 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -55.37 -44.57 76.18 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.685 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.9 t -46.59 -13.92 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.72 -179.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -93.58 30.95 1.63 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.493 0.663 . . . . 0.0 110.502 179.334 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.42 18.9 7.79 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.55 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.72 -90.65 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.932 -0.652 . . . . 0.0 113.639 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.426 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -113.12 -60.39 1.89 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.089 0.947 . . . . 0.0 112.219 -178.521 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.619 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 65.86 84.65 0.15 Allowed 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.854 -1.521 . . . . 0.0 108.116 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.522 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 0.0 OUTLIER -50.39 -17.77 0.53 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.241 -178.04 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.695 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 20.1 m-85 -136.67 51.21 2.0 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -37.83 120.43 0.85 Allowed Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 114.299 -178.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 75.39 -17.59 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.0 0.52 . . . . 0.0 112.048 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.425 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -125.13 19.8 8.27 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.446 -179.369 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.695 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.3 p -81.57 122.61 27.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -177.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -115.44 -19.96 10.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.946 -1.479 . . . . 0.0 109.298 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.434 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 90.8 m-85 -156.99 -128.9 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.201 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.581 ' O ' ' HB3' ' A' ' 13' ' ' GLU . . . 45.29 -157.49 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 121.138 0.494 . . . . 0.0 111.783 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.737 ' HA ' ' CE2' ' A' ' 18' ' ' TYR . 0.4 OUTLIER 78.71 -147.73 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.616 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.57 -161.26 0.51 Allowed Glycine 0 C--N 1.35 1.351 0 CA-C-O 121.237 0.354 . . . . 0.0 113.73 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.506 ' O ' HD21 ' A' ' 14' ' ' LEU . 5.8 tt -55.02 116.57 2.84 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.174 -0.513 . . . . 0.0 111.82 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.446 ' HA3' HD12 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.439 -1.151 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.336 177.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.44 -0.925 0 CA-C-O 121.272 0.558 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 t -127.38 19.72 6.83 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.103 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.739 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.2 mt-10 -100.99 -169.7 1.74 Allowed 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -178.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.667 ' CD2' ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -164.06 156.11 16.84 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.718 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.759 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 26.5 t -76.39 87.58 3.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.237 178.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.667 ' HG2' ' CD2' ' A' ' 14' ' ' LEU . 2.1 mmm-85 -74.9 -104.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.448 HG22 ' HD1' ' A' ' 18' ' ' TYR . 15.3 t -74.65 -17.09 60.74 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 121.76 0.79 . . . . 0.0 110.587 -179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.598 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.6 m-85 -56.16 -42.3 76.8 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.12 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -25.6 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.934 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 21' ' ' SER . 0.0 OUTLIER -66.5 -44.08 83.59 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.445 179.456 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 33.8 p 153.09 19.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.072 179.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.99 -95.84 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.694 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.478 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -115.56 -58.27 2.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.909 0.862 . . . . 0.0 112.608 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.73 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.2 m 68.92 82.64 0.17 Allowed 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 113.736 -1.575 . . . . 0.0 107.535 -176.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.572 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 5.5 tpp85 -47.02 -21.0 0.17 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.418 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.624 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 21.0 m-85 -140.38 54.35 1.62 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.73 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.93 -30.23 0.04 OUTLIER Glycine 0 N--CA 1.467 0.744 0 N-CA-C 115.924 1.13 . . . . 0.0 115.924 -177.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -114.17 -12.7 12.47 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.988 0.894 . . . . 0.0 111.283 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.436 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -131.61 31.08 4.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.525 -178.574 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.624 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 30.8 p -86.01 108.68 18.34 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -15.16 13.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.022 -1.444 . . . . 0.0 108.335 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.434 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.3 m-85 -157.28 -133.21 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.205 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.598 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 45.8 -156.34 0.03 OUTLIER 'General case' 0 N--CA 1.458 -0.071 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.759 ' CD2' ' HA ' ' A' ' 15' ' ' CYS . 0.3 OUTLIER 76.9 -165.36 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.882 179.573 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 36' ' ' LEU . . . -59.11 108.24 1.53 Allowed Glycine 0 C--N 1.34 0.778 0 CA-C-N 115.84 -0.618 . . . . 0.0 113.507 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' A' ' 35' ' ' GLY . 3.1 tt 51.41 161.09 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.756 0.789 . . . . 0.0 111.557 178.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.739 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.433 -1.544 0 CA-C-N 115.124 -0.944 . . . . 0.0 113.019 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.586 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 18.9 mttt . . . . . 0 N--CA 1.446 -0.63 0 CA-C-O 121.6 0.714 . . . . 0.0 111.344 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.4 t -126.75 1.99 6.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.901 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.713 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -82.62 -169.11 2.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.529 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.794 HD22 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -162.2 155.23 20.21 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.705 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 36.0 t -77.72 85.27 4.03 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.794 ' HG2' HD22 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -71.48 -101.74 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.158 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 t -77.07 -23.12 51.97 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.001 0.905 . . . . 0.0 110.076 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.564 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -47.33 -51.39 19.53 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.277 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.78 -12.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.414 ' H ' ' C ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -98.08 34.66 1.89 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.508 0.671 . . . . 0.0 110.347 179.398 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.32 16.65 9.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.359 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.2 -90.9 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.809 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.47 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -112.2 -65.33 1.19 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.585 0.707 . . . . 0.0 111.685 -179.102 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 64.82 81.8 0.2 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.024 -178.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.596 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 4.9 tpp85 -55.6 -13.61 1.69 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.049 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.77 ' CE2' ' HB2' ' A' ' 33' ' ' ALA . 15.5 m-30 -139.63 52.3 1.72 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -38.26 117.41 0.59 Allowed Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.114 -0.565 . . . . 0.0 114.333 -178.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 78.95 -18.32 0.52 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -121.27 10.24 10.57 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.797 -179.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.563 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 16.5 p -74.66 130.94 40.43 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -177.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.461 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -132.21 -14.76 2.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.092 177.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.586 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 97.1 m-85 -158.89 -81.77 0.05 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.77 ' HB2' ' CE2' ' A' ' 26' ' ' TYR . . . -37.29 102.56 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 111.192 -177.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.48 -154.99 0.22 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.327 -179.062 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.551 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -62.69 97.63 0.19 Allowed Glycine 0 CA--C 1.496 -1.135 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 178.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 59.21 164.18 0.05 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.336 0.589 . . . . 0.0 110.129 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.713 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.43 -1.755 0 C-N-CA 120.17 -1.014 . . . . 0.0 113.187 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.436 ' O ' ' O ' ' A' ' 37' ' ' GLY . 3.4 t -132.92 24.85 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.365 -178.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.499 ' OE2' ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -118.93 177.6 4.8 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -178.785 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.611 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -159.51 142.03 13.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.137 0.494 . . . . 0.0 112.205 -177.454 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.517 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.0 t -69.18 82.61 0.35 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.897 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.611 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -75.95 -99.62 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.704 0.288 . . . . 0.0 111.66 -178.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.4 HG23 ' HD1' ' A' ' 18' ' ' TYR . 11.4 t -72.97 -23.94 60.72 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.728 0.775 . . . . 0.0 109.974 179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.557 ' CE1' ' CA ' ' A' ' 35' ' ' GLY . 3.0 m-85 -50.22 -47.15 55.01 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.923 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 p -49.12 -18.14 0.29 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.559 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.12 33.04 2.74 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.585 0.707 . . . . 0.0 110.62 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.99 17.28 8.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.292 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . 0.493 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.54 -19.8 73.18 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.725 -179.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 175.68 -69.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.716 0.769 . . . . 0.0 112.257 -179.259 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.712 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.7 m 64.26 81.48 0.21 Allowed 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.445 -1.252 . . . . 0.0 109.643 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.9 tpt180 -49.71 -19.46 0.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.112 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.568 ' O ' ' N ' ' A' ' 30' ' ' CYS . 24.2 m-85 -143.18 43.4 1.54 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.504 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.37 134.5 0.94 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.207 -0.52 . . . . 0.0 113.823 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 72.53 -24.67 0.19 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.996 0.427 . . . . 0.0 111.657 -178.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.504 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -121.54 10.71 10.48 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.349 -179.001 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.568 ' N ' ' O ' ' A' ' 26' ' ' TYR . 25.6 p -79.8 118.67 21.8 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -110.34 -24.27 10.73 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.431 -1.258 . . . . 0.0 108.094 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.445 ' O ' ' O ' ' A' ' 33' ' ' ALA . 89.4 m-85 -161.14 -151.37 0.23 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.376 -1.284 . . . . 0.0 108.916 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.541 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 41.51 95.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 110.486 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.712 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.0 -143.22 0.06 Allowed 'General case' 0 CA--C 1.555 1.151 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.826 -177.88 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.557 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -63.94 118.95 14.38 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 122.171 -0.33 . . . . 0.0 113.248 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.3 tt 46.55 -91.48 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.449 ' CA ' HD12 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.447 -0.613 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.619 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mttp . . . . . 0 N--CA 1.454 -0.243 0 CA-C-O 121.246 0.546 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -134.11 36.4 3.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.637 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.542 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -127.52 -175.2 3.39 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 -178.825 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.639 HD13 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -169.04 148.4 4.07 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-O 121.189 0.518 . . . . 0.0 112.181 -179.24 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.587 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 15.2 t -69.42 78.22 0.39 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.507 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -68.77 -95.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.8 t -77.91 -22.1 50.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.839 0.828 . . . . 0.0 110.257 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.713 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.4 m-85 -50.7 -43.49 57.78 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.494 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.4 p -56.3 -38.0 70.66 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.523 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -57.01 -47.56 80.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.223 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.523 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 0.3 OUTLIER 156.24 30.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.518 179.684 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.79 -96.49 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.954 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.413 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -120.12 -52.0 2.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.016 0.912 . . . . 0.0 111.755 -179.017 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.736 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 62.79 76.47 0.36 Allowed 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.835 -1.529 . . . . 0.0 108.281 -177.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 5.8 tpt180 -46.93 -21.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.375 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.565 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 27.7 m-85 -139.8 42.96 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.457 ' CA ' ' HB3' ' A' ' 24' ' ' CYS . . . -37.99 126.63 1.52 Allowed Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.937 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' A' ' 27' ' ' GLY . . . 86.03 -35.48 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.007 0.523 . . . . 0.0 111.874 -179.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 ttpt -114.81 9.27 16.25 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.052 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.565 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.2 p -72.5 116.12 12.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -176.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.415 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -109.24 -21.97 12.3 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.114 177.074 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.415 ' CG ' ' O ' ' A' ' 31' ' ' GLN . 86.2 m-85 -160.96 -157.49 0.52 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.553 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.606 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 41.94 102.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 178.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.736 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -165.28 -111.61 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.717 179.222 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.414 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -69.46 -119.71 0.03 OUTLIER Glycine 0 C--N 1.349 1.293 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.14 -73.6 0.16 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.943 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.639 ' HA2' HD13 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.444 -0.794 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.263 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HE3' ' HE2' ' A' ' 26' ' ' TYR . 9.3 mttm . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.267 0.556 . . . . 0.0 111.355 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.3 t -127.83 5.67 6.05 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.134 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.619 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 1.4 mt-10 -87.08 -176.47 5.72 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.722 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -160.9 149.4 16.26 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.379 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.598 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.2 t -72.49 86.32 1.16 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.71 178.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.722 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.11 -100.76 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -178.614 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' THR . . . . . 0.43 HG23 ' HD1' ' A' ' 18' ' ' TYR . 14.0 t -71.33 -23.19 61.89 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.702 0.763 . . . . 0.0 110.234 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.565 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.14 -50.12 49.78 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 114.595 -1.184 . . . . 0.0 112.181 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.463 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 88.8 p -56.01 -28.03 55.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.945 0.402 . . . . 0.0 112.058 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 21' ' ' SER . 2.2 tt0 -74.15 -39.81 63.03 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.91 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.518 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 35.0 t 159.36 10.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.536 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.48 -88.53 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.729 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -138.11 -57.81 0.66 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.144 0.973 . . . . 0.0 112.154 -178.123 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.723 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 74.22 77.37 0.12 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 113.217 -1.81 . . . . 0.0 108.381 -177.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 18.9 tpp180 -49.11 -16.92 0.17 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.725 -178.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.508 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 21.9 m-85 -142.95 48.96 1.48 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.446 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.61 126.66 1.79 Allowed Glycine 0 C--N 1.332 0.355 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.737 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.06 -18.44 0.44 Allowed 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 123.077 0.551 . . . . 0.0 112.202 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.79 17.88 6.79 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.57 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.508 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 23.7 p -85.01 115.61 22.93 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -177.114 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -112.09 -19.78 12.18 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.192 176.553 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.457 ' O ' ' O ' ' A' ' 33' ' ' ALA . 86.6 m-85 -160.75 -157.82 0.56 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.563 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.551 ' H ' ' HB2' ' A' ' 13' ' ' GLU . . . 42.34 98.25 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.143 0.177 . . . . 0.0 110.556 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.723 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.15 -142.23 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -178.241 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.515 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -56.87 -91.09 0.01 OUTLIER Glycine 0 C--N 1.35 1.329 0 N-CA-C 111.664 -0.575 . . . . 0.0 111.664 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.496 ' HB3' HD22 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -78.71 -152.53 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.409 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.619 ' CA ' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.439 -1.117 0 C-N-CA 119.615 -1.279 . . . . 0.0 114.12 179.251 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 120.724 0.297 . . . . 0.0 110.865 . . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 t -129.83 31.06 4.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.991 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.481 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.4 mt-10 -125.06 -167.52 1.69 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.218 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.522 ' N ' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -166.25 155.88 11.79 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 112.061 -178.414 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.6 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.9 t -72.35 78.8 1.01 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.25 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.473 ' HG2' HD23 ' A' ' 14' ' ' LEU . 4.8 mmm180 -70.27 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.021 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.8 t -71.47 -20.65 62.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.668 0.746 . . . . 0.0 110.626 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.626 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -55.25 -47.05 75.98 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.798 -179.181 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -13.21 0.06 Allowed 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.282 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.41 31.49 1.97 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.625 0.726 . . . . 0.0 110.565 179.401 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.5 t 70.55 17.43 6.74 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.841 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -92.41 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.784 -0.722 . . . . 0.0 113.128 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.98 -61.78 1.64 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.982 0.896 . . . . 0.0 111.899 -178.999 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.73 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 63.71 81.39 0.21 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.046 -1.434 . . . . 0.0 108.684 -177.877 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.562 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -52.51 -19.87 2.55 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.285 -178.401 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.569 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.2 m-85 -137.36 49.55 2.0 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.149 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.41 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.82 119.98 0.8 Allowed Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.174 -0.467 . . . . 0.0 113.808 -179.188 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 77.14 -20.53 0.37 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 122.652 0.381 . . . . 0.0 111.627 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.473 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -118.95 15.38 13.36 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.927 179.891 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 24.9 p -83.97 130.91 34.88 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.013 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -128.26 -18.38 4.09 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.056 -1.429 . . . . 0.0 110.201 178.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.481 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 95.3 m-85 -158.16 -74.48 0.09 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.644 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.685 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -41.43 105.12 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.796 -177.162 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.73 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.53 -133.33 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.732 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.47 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -68.64 -118.7 0.03 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.584 0.629 . . . . 0.0 111.736 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.495 ' O ' HD21 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -70.89 -170.17 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.286 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.481 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.441 -1.011 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.457 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.46 0.648 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.09 -22.32 11.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.469 -178.445 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.724 ' O ' ' HD2' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -79.4 -178.78 6.43 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.164 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.575 HD11 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -166.25 150.31 7.69 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.067 -178.582 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.606 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 9.2 t -67.74 77.48 0.2 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.454 ' HG2' ' CD2' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -67.02 -95.35 0.0 OUTLIER 'General case' 0 C--N 1.344 0.334 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 -178.896 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -80.39 -23.07 40.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 121.819 0.818 . . . . 0.0 110.054 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -48.42 -44.95 35.64 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.338 -1.301 . . . . 0.0 111.632 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.93 -11.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.71 32.77 1.37 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.536 0.684 . . . . 0.0 110.341 179.432 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m 65.45 28.65 11.56 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.664 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.06 -97.46 0.1 OUTLIER Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 116.048 -0.524 . . . . 0.0 113.062 -179.561 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.09 -58.59 1.86 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.719 0.771 . . . . 0.0 111.851 -179.155 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.704 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 58.04 81.04 0.16 Allowed 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.177 -177.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.474 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 6.6 tpm_? -51.64 -18.49 1.19 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.148 -178.738 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.522 ' O ' ' N ' ' A' ' 30' ' ' CYS . 25.9 m-85 -139.71 44.92 1.93 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.487 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.476 ' O ' ' HB1' ' A' ' 28' ' ' ALA . . . -37.91 128.88 1.54 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.804 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.476 ' HB1' ' O ' ' A' ' 27' ' ' GLY . . . 75.37 -24.49 0.22 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.051 -179.6 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . 0.418 ' H ' ' C ' ' A' ' 27' ' ' GLY . 5.1 ttpt -121.45 15.97 11.27 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.771 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.2 p -87.16 114.37 23.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -176.475 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.427 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -110.14 -19.12 13.15 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.769 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.724 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 86.5 m-85 -160.66 -160.99 0.8 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.896 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.59 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 46.58 98.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.73 178.754 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.704 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.21 -111.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.81 179.369 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.424 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -73.45 -127.37 0.12 Allowed Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 -179.62 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -74.68 0.07 Allowed 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.219 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.451 -0.341 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.842 178.845 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 CA-C-O 121.281 0.563 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -119.12 -8.86 10.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.635 -178.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.649 ' O ' ' HD2' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -81.95 -174.87 5.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.177 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.65 ' CD2' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -167.98 154.86 7.93 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 121.043 0.449 . . . . 0.0 111.506 -178.825 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' CYS . . . . . 0.599 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.8 t -72.47 83.31 1.09 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.226 179.541 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.65 ' HG3' ' CD2' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.86 -101.09 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -178.345 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -70.89 -20.35 62.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.783 0.801 . . . . 0.0 109.862 179.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.708 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -55.53 -48.02 75.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.659 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.6 t -45.88 -27.85 0.97 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.242 -178.897 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.595 ' O ' ' CB ' ' A' ' 21' ' ' SER . 0.7 OUTLIER -76.3 -31.89 58.45 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.067 -179.802 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.595 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 10.7 t 138.31 2.43 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.998 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.78 -38.5 10.06 Favored Glycine 0 C--N 1.332 0.311 0 N-CA-C 114.726 0.651 . . . . 0.0 114.726 -178.899 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.47 -62.35 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.703 0.763 . . . . 0.0 112.611 -178.396 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . 0.695 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 65.64 80.88 0.22 Allowed 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.133 -1.394 . . . . 0.0 109.096 -177.72 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.408 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 tpm_? -50.25 -21.23 1.28 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.733 -179.319 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' TYR . . . . . 0.578 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 24.9 m-85 -140.62 55.07 1.59 Allowed 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.285 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLY . . . . . 0.656 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.64 -35.39 0.12 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 115.61 1.004 . . . . 0.0 115.61 -177.224 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.69 -18.48 13.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 118.167 0.983 . . . . 0.0 112.085 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.22 28.52 6.02 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.952 -178.162 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' CYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 31.8 p -87.24 116.85 25.6 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -177.549 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.488 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -120.42 -14.02 8.76 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.945 178.585 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.649 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.9 m-85 -158.33 -85.88 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -178.959 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.583 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -34.9 109.55 0.08 Allowed 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -177.84 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.708 ' CG ' ' CD2' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -162.95 -112.06 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.287 178.415 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.472 ' HA2' ' CE1' ' A' ' 18' ' ' TYR . . . -58.41 -100.15 0.01 OUTLIER Glycine 0 C--N 1.348 1.226 0 N-CA-C 112.728 -0.149 . . . . 0.0 112.728 -179.237 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' LEU . . . . . 0.407 HD12 ' CD ' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -116.3 -42.13 3.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.838 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.619 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.45 -0.4 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.847 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.782 0.325 . . . . 0.0 111.336 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 57.38 -168.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.707 -179.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 59.8 p -56.29 143.83 32.56 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.797 0.332 . . . . 0.0 110.964 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.21 46.54 0.91 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.791 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -177.18 -71.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.513 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.438 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 2.8 tpp85 61.7 151.47 0.03 OUTLIER 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.254 0.55 . . . . 0.0 111.076 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.474 ' CB ' ' CE1' ' A' ' 32' ' ' PHE . 3.9 m-85 -63.95 -162.84 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.058 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.48 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -67.97 -166.2 0.06 Allowed 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 121.302 0.572 . . . . 0.0 111.266 -178.466 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.669 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 3.0 t -119.87 1.0 10.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.191 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -81.57 -173.74 4.57 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.384 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.591 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -161.12 147.92 14.94 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.857 -179.362 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.604 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 18.8 t -72.34 85.9 1.11 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.591 ' HG3' HD23 ' A' ' 14' ' ' LEU . 1.1 mtp85 -78.07 -101.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -71.66 -21.48 61.81 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.737 0.78 . . . . 0.0 110.047 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.592 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -52.99 -48.07 67.76 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.493 -1.231 . . . . 0.0 112.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.12 -12.8 0.09 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.843 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.39 32.96 2.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.473 0.654 . . . . 0.0 110.6 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 70.02 15.11 7.78 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.689 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.0 -88.62 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.954 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.421 ' HE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -114.93 -64.45 1.31 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.843 0.83 . . . . 0.0 112.153 -178.725 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.713 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.17 83.97 0.16 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.711 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.57 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 16.2 tpt85 -55.36 -14.1 1.72 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.439 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.638 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 20.7 m-85 -139.2 51.91 1.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -38.4 118.81 0.76 Allowed Glycine 0 CA--C 1.52 0.401 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.943 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 75.7 -14.97 0.73 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.736 0.414 . . . . 0.0 111.967 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.474 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -124.94 17.09 8.57 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.273 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.638 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 27.3 p -84.3 132.59 34.6 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.143 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.418 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -131.17 -17.36 3.05 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.65 -1.613 . . . . 0.0 110.38 178.827 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.48 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 82.8 m-85 -157.75 -85.79 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.597 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -33.26 105.57 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -177.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.713 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -161.99 -139.67 0.05 Allowed 'General case' 0 CA--C 1.557 1.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 -179.325 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -50.68 -113.53 0.01 OUTLIER Glycine 0 C--N 1.348 1.218 0 CA-C-N 118.118 0.417 . . . . 0.0 114.015 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.434 HD22 ' HG3' ' A' ' 38' ' ' GLU . 0.3 OUTLIER -63.14 -75.19 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.96 0.409 . . . . 0.0 111.436 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 49.77 79.75 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.864 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.434 ' HG3' HD22 ' A' ' 36' ' ' LEU . 4.7 mt-10 -134.37 39.39 3.07 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.122 0.486 . . . . 0.0 109.69 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.49 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 11.1 mt -54.35 -46.38 72.93 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.582 -178.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.669 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -101.01 37.52 1.73 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.759 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.523 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 24.2 mm-40 -152.03 12.86 0.59 Allowed 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.551 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 178.74 -22.45 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.33 -0.395 . . . . 0.0 112.007 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.49 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.122 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.941 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.4 ttp . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.956 0.408 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 46.3 p -135.58 -52.11 0.75 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.522 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.478 ' OG1' ' HB2' ' A' ' 9' ' ' ARG . 10.2 t -66.87 167.59 11.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.283 -179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.28 -40.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.918 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.0 m -86.21 -16.66 37.04 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.556 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.478 ' HB2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -68.11 -175.43 0.59 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.677 0.275 . . . . 0.0 110.489 179.48 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.649 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 5.1 m-85 -76.99 -165.33 0.54 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.895 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.463 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -71.21 -167.53 0.23 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.956 0.407 . . . . 0.0 110.965 -179.015 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.682 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 2.9 t -127.84 2.61 6.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.208 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.644 ' CG ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -86.67 -174.03 4.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.454 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.68 HD13 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -169.01 156.51 7.32 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.554 0.692 . . . . 0.0 112.571 -179.201 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.648 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 5.1 t -71.17 84.02 0.73 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.692 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.615 ' HG2' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -70.04 -97.71 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.822 0.344 . . . . 0.0 111.504 -179.109 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -81.59 -19.82 41.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 122.055 0.931 . . . . 0.0 110.171 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.709 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -50.61 -51.12 51.61 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.388 -1.278 . . . . 0.0 112.567 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.11 -32.29 22.16 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.897 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.458 ' O ' ' CB ' ' A' ' 21' ' ' SER . 3.7 tt0 -68.16 -40.89 82.21 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.113 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 0.4 OUTLIER 158.64 18.63 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.93 -90.76 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 121.386 -0.435 . . . . 0.0 113.735 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.443 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 1.3 ttt180 -133.36 -57.15 0.9 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.123 0.963 . . . . 0.0 112.272 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.688 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 72.46 79.85 0.15 Allowed 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.369 -1.741 . . . . 0.0 108.531 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 12.0 tpt180 -50.96 -16.91 0.49 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.441 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 30' ' ' CYS . 18.1 m-85 -140.91 49.9 1.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.441 ' O ' ' HB1' ' A' ' 28' ' ' ALA . . . -37.83 126.02 1.42 Allowed Glycine 0 C--N 1.335 0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.212 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.441 ' HB1' ' O ' ' A' ' 27' ' ' GLY . . . 70.96 -14.35 0.45 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.14 -0.53 . . . . 0.0 112.219 -179.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.419 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -127.85 17.58 6.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 122.688 0.395 . . . . 0.0 111.299 -179.542 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' TYR . 26.6 p -87.37 107.28 18.46 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.507 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -103.67 -16.86 15.35 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.046 176.283 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.649 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 97.6 m-85 -153.71 -138.79 0.08 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.793 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.662 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 51.75 -158.94 0.11 Allowed 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.334 -0.229 . . . . 0.0 111.093 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.709 ' HA ' ' CE2' ' A' ' 18' ' ' TYR . 0.3 OUTLIER 83.59 -147.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 178.994 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.43 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -61.39 -132.42 0.01 OUTLIER Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.262 0.465 . . . . 0.0 114.262 -178.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.431 HD22 ' HB2' ' A' ' 38' ' ' GLU . 1.0 OUTLIER -37.22 -77.12 0.02 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.656 -0.772 . . . . 0.0 111.502 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.68 ' HA2' HD13 ' A' ' 14' ' ' LEU . . . 52.23 20.82 7.33 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.275 -0.488 . . . . 0.0 113.937 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.508 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 2.5 mt-10 -85.51 46.3 1.29 Allowed 'General case' 0 C--N 1.312 -1.048 0 O-C-N 122.588 -0.36 . . . . 0.0 111.364 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.551 ' CD1' HD11 ' A' ' 14' ' ' LEU . 20.7 mt -54.1 -56.02 22.09 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.584 0.706 . . . . 0.0 110.934 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.682 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -93.15 39.87 1.05 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.5 -1.227 . . . . 0.0 111.031 -179.483 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.587 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 16.7 mt-30 -153.73 -58.14 0.12 Allowed 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.07 0.462 . . . . 0.0 110.362 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 56.69 -177.81 0.05 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.24 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.165 -0.922 . . . . 0.0 110.993 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.9 mtt . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.747 0.308 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.9 t -84.63 138.3 32.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.857 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -108.93 -31.34 7.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.159 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.0 p 65.72 34.99 7.16 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.999 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.5 m 60.14 71.37 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.869 0.366 . . . . 0.0 110.84 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 153.72 30.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.976 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.56 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.7 m-85 -73.72 -164.25 0.21 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.411 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.411 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -69.67 -166.7 0.11 Allowed 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.06 0.457 . . . . 0.0 110.765 -179.126 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.636 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 6.1 t -121.67 -3.92 9.25 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.447 -179.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.762 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -79.91 -170.45 2.44 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.93 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' O ' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -166.06 144.84 5.88 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.337 0.589 . . . . 0.0 111.899 -179.089 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.622 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -71.16 84.73 0.74 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.537 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.438 ' CD ' HD11 ' A' ' 36' ' ' LEU . 3.8 mtp180 -79.48 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -71.34 -18.91 62.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.548 0.689 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.692 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.8 m-85 -53.55 -48.08 69.44 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.943 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.52 -36.77 7.07 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.18 0.514 . . . . 0.0 111.747 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.526 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.6 tt0 -67.73 -38.17 83.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 14.4 t 150.53 -0.72 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.718 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -43.25 -41.11 4.85 Favored Glycine 0 C--N 1.332 0.342 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -178.26 -60.27 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.463 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.73 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 67.26 80.78 0.21 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.661 -176.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.59 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 3.9 tpp180 -52.52 -18.72 1.84 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.674 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.678 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 23.6 m-85 -137.09 49.76 2.02 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.512 ' O ' ' HB1' ' A' ' 28' ' ' ALA . . . -37.09 122.22 0.85 Allowed Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.199 -0.524 . . . . 0.0 114.08 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.512 ' HB1' ' O ' ' A' ' 27' ' ' GLY . . . 78.21 -25.81 0.19 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.643 0.777 . . . . 0.0 112.333 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -115.25 8.52 15.52 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.474 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.678 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 21.8 p -72.09 131.48 42.9 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.422 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -127.57 -17.73 4.53 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.299 179.202 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.56 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 91.0 m-85 -158.62 -84.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.689 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -33.26 107.12 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.73 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.27 -116.16 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.589 178.534 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.442 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -55.04 -103.22 0.01 OUTLIER Glycine 0 C--N 1.354 1.582 0 O-C-N 122.43 -0.169 . . . . 0.0 113.401 -178.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.438 HD11 ' CD ' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -100.45 -58.09 1.98 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.762 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 50.32 86.02 0.02 OUTLIER Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.377 -0.829 . . . . 0.0 113.749 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -128.2 46.85 2.51 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.126 -0.537 . . . . 0.0 110.552 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.481 ' HG ' ' CD1' ' A' ' 14' ' ' LEU . 11.3 mt -59.84 -30.22 68.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.667 -179.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.636 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -127.13 35.19 4.61 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.503 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.591 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 1.9 mm-40 -151.09 72.48 1.06 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.618 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -51.05 178.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.344 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.746 179.939 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.6 ttm . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.747 0.308 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.66 -78.96 0.16 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.89 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.84 148.98 36.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.862 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.8 m -111.2 -37.38 5.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.023 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.58 93.31 0.92 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.813 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.14 -173.08 4.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.163 0.506 . . . . 0.0 111.019 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.494 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 3.6 m-85 -78.22 -161.82 0.3 Allowed 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.125 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -62.68 -161.78 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.628 -178.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.464 ' O ' ' OG1' ' A' ' 12' ' ' THR . 0.6 OUTLIER -129.55 41.12 3.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.125 -178.268 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.58 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.2 mt-10 -132.2 -168.36 2.03 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.516 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -164.21 142.05 7.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.148 0.499 . . . . 0.0 111.597 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.577 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.6 t -66.97 79.26 0.12 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.842 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.493 ' HG3' HD22 ' A' ' 14' ' ' LEU . 6.5 mtp85 -72.26 -97.96 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.626 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -74.59 -23.47 58.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.87 0.843 . . . . 0.0 109.958 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.6 m-85 -49.91 -48.58 51.6 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.456 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.56 -37.59 63.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.618 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.476 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.5 tt0 -58.43 -44.62 89.21 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 1.9 p 154.12 28.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.678 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.24 -95.15 0.08 OUTLIER Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.278 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.411 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -121.02 -54.01 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 122.05 0.929 . . . . 0.0 111.925 -178.586 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.733 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 64.05 78.96 0.27 Allowed 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.388 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.529 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -47.39 -21.51 0.32 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.443 -178.217 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.643 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 25.9 m-85 -133.45 47.68 2.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -38.11 120.76 0.94 Allowed Glycine 0 C--N 1.332 0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 114.109 -179.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 81.51 -23.23 0.23 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.098 0.559 . . . . 0.0 112.221 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.51 19.51 9.61 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.245 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.643 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.7 p -84.43 127.48 34.04 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -176.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -123.16 -22.16 5.23 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.22 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.494 ' CD1' ' HB3' ' A' ' 10' ' ' TYR . 97.5 m-85 -160.54 -165.37 1.41 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.288 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.594 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 49.14 100.84 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.111 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.733 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -164.23 -109.81 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.092 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.423 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -75.66 -118.8 0.12 Allowed Glycine 0 C--N 1.349 1.252 0 CA-C-O 121.089 0.272 . . . . 0.0 113.024 -179.171 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -78.69 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.757 0.313 . . . . 0.0 111.202 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.58 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 44.28 80.07 0.05 OUTLIER Glycine 0 C--N 1.333 0.389 0 CA-C-O 121.371 0.429 . . . . 0.0 113.972 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -135.73 41.2 2.73 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.064 -0.568 . . . . 0.0 109.992 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.3 mt -82.95 -23.51 33.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.788 179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.415 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -121.58 55.02 1.11 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.136 179.476 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.415 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 88.3 mt-30 -158.74 10.71 0.15 Allowed 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.404 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 178.22 -62.63 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 120.84 0.352 . . . . 0.0 111.289 179.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.5 m120 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.015 -179.777 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.44 ' O ' ' OG1' ' A' ' 5' ' ' THR . 14.0 ttt . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 120.725 0.298 . . . . 0.0 111.19 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' A' ' 4' ' ' MET . 7.7 p 67.34 18.13 10.2 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.362 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.4 p -105.1 123.85 48.53 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.575 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.2 t -112.01 -63.72 1.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.849 0.357 . . . . 0.0 110.86 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.98 -73.56 0.68 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.056 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.39 -167.62 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.021 0.439 . . . . 0.0 110.601 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.466 ' CB ' ' CE2' ' A' ' 32' ' ' PHE . 4.1 m-85 -86.24 -163.03 0.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.88 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -72.47 -164.96 0.17 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.198 0.523 . . . . 0.0 112.143 -178.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.452 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 2.6 t -129.01 37.32 4.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.932 -178.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.616 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.2 mt-10 -118.67 -174.37 2.67 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.447 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.858 HD12 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -157.09 150.75 24.38 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.872 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.578 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -74.92 88.09 2.32 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.373 178.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.524 ' HG3' HD22 ' A' ' 14' ' ' LEU . 16.5 mtp180 -77.13 -99.88 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.2 t -73.06 -23.44 60.57 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.852 0.834 . . . . 0.0 110.061 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -49.54 -50.34 42.46 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.746 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 38.4 p -46.01 -15.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.268 -0.878 . . . . 0.0 113.353 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.1 OUTLIER -98.64 35.14 1.88 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.538 0.685 . . . . 0.0 110.961 -179.512 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 4.2 m 68.6 17.4 8.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.519 -1.218 . . . . 0.0 112.072 178.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.3 -88.25 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.25 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.44 -62.18 1.63 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.874 0.845 . . . . 0.0 111.563 -178.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.687 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.8 m 61.38 80.12 0.23 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.605 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.431 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -49.22 -21.47 0.8 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.037 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.556 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 19.6 m-85 -135.88 48.06 2.22 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.404 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -37.76 121.45 0.94 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 121.266 -0.492 . . . . 0.0 114.156 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 80.74 -25.55 0.17 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.239 0.615 . . . . 0.0 112.438 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -116.77 7.92 13.54 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.546 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.556 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.5 p -71.12 132.84 45.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.127 0.965 . . . . 0.0 113.557 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.74 -17.3 2.52 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 113.522 -1.672 . . . . 0.0 110.211 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.466 ' CE2' ' CB ' ' A' ' 10' ' ' TYR . 89.6 m-85 -157.98 -80.69 0.06 Allowed 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.659 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -40.41 109.72 0.12 Allowed 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.855 -177.429 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.687 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -169.51 -145.5 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.546 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.448 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -66.76 99.2 0.46 Allowed Glycine 0 C--N 1.345 1.06 0 O-C-N 122.042 -0.411 . . . . 0.0 112.3 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.403 ' O ' ' O ' ' A' ' 35' ' ' GLY . 2.5 tt 54.9 169.13 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.298 0.57 . . . . 0.0 110.246 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.858 ' HA2' HD12 ' A' ' 14' ' ' LEU . . . -177.76 -101.08 0.14 Allowed Glycine 0 N--CA 1.431 -1.693 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.435 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' A' ' 41' ' ' GLN . 35.5 mt-10 50.74 23.32 1.35 Allowed 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.526 ' CD1' HD13 ' A' ' 14' ' ' LEU . 6.2 mt -38.88 -43.58 0.96 Allowed 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.438 0.637 . . . . 0.0 111.035 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.452 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -99.05 35.56 1.87 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.537 179.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' A' ' 38' ' ' GLU . 30.3 mt-30 -162.72 57.76 0.21 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.922 0.391 . . . . 0.0 110.79 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -46.21 141.57 3.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.91 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.354 -0.832 . . . . 0.0 110.845 179.755 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 120.874 0.369 . . . . 0.0 111.364 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.57 50.16 0.61 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.402 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 6.2 p 51.4 102.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.382 -179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.7 p -58.68 137.81 57.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.269 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 70.26 -64.4 0.36 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.101 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.39 161.24 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.41 -179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.491 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 4.1 m-85 -80.33 -163.35 0.55 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.971 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -70.84 -163.62 0.08 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.281 0.563 . . . . 0.0 112.098 -178.247 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.61 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 5.6 t -128.12 36.69 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.679 -178.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.504 ' HB3' ' O ' ' A' ' 32' ' ' PHE . 0.6 OUTLIER -121.46 -170.09 1.97 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.15 -179.329 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.76 ' O ' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -164.25 143.91 7.75 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.022 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.61 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 17.7 t -64.87 84.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.469 ' CZ ' ' HG ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.83 -100.88 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.675 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.1 t -69.69 -25.99 64.15 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.935 0.874 . . . . 0.0 109.913 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.1 m-85 -50.17 -53.04 30.5 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.309 -1.314 . . . . 0.0 111.238 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -46.67 -12.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.166 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.21 31.05 2.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.407 0.622 . . . . 0.0 110.667 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m 69.4 21.18 7.02 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.024 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.66 -92.75 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.059 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -64.18 1.2 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.917 0.865 . . . . 0.0 111.52 -179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.738 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.3 m 62.28 79.85 0.24 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.435 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.602 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 27.2 tpt180 -47.96 -20.31 0.32 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.12 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.665 ' HB2' ' CA ' ' A' ' 30' ' ' CYS . 17.8 m-85 -140.83 57.59 1.56 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.738 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -37.02 -35.08 0.12 Allowed Glycine 0 N--CA 1.465 0.601 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 -177.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.96 -16.66 13.06 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.321 1.06 . . . . 0.0 111.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 25.52 7.42 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.174 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.665 ' CA ' ' HB2' ' A' ' 26' ' ' TYR . 30.2 p -81.62 129.13 34.58 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.71 -15.4 2.09 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.589 -1.642 . . . . 0.0 110.253 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.504 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 81.2 m-85 -157.66 -82.33 0.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.602 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . -37.75 102.98 0.03 OUTLIER 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.522 -177.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.682 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.93 -138.51 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.451 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.483 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -67.71 -163.95 2.4 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 118.312 0.505 . . . . 0.0 112.283 178.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.485 ' O ' HD23 ' A' ' 14' ' ' LEU . 7.8 tt -44.95 117.01 1.2 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.106 0.479 . . . . 0.0 110.321 179.036 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.654 ' HA3' HD22 ' A' ' 14' ' ' LEU . . . -159.89 90.56 0.11 Allowed Glycine 0 N--CA 1.44 -1.036 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.662 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 2.0 mm-40 -110.12 39.36 2.18 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.099 -0.55 . . . . 0.0 111.564 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.436 ' CD1' HD12 ' A' ' 14' ' ' LEU . 5.3 mt -39.79 -41.14 1.07 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.168 0.508 . . . . 0.0 111.936 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.61 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -112.48 39.23 2.52 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.151 179.32 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.662 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 77.5 mt-30 -155.13 -16.99 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.775 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.87 113.81 2.48 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 120.908 0.385 . . . . 0.0 111.162 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.807 -179.976 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 120.77 0.319 . . . . 0.0 111.34 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.33 83.63 2.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.78 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.2 p -96.52 109.72 22.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.936 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -81.17 105.54 12.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.722 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m 73.92 -65.44 0.35 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.634 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.0 tpp180 62.97 159.18 0.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.664 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.547 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 5.3 m-85 -68.82 -163.31 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.908 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.425 ' HB2' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -60.47 -166.81 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.365 0.602 . . . . 0.0 112.103 -178.304 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.481 HG21 ' HB2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -112.07 -26.66 8.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.968 -1.014 . . . . 0.0 112.795 -178.359 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.754 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -79.49 -175.41 4.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.417 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.775 HD11 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -167.86 152.0 6.37 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.47 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.63 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.5 t -70.31 84.07 0.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.997 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.435 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.35 -100.2 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.839 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.1 t -72.38 -23.21 61.08 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.736 0.779 . . . . 0.0 110.432 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.59 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -52.52 -45.34 66.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.876 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -49.77 -11.08 0.05 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.734 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.41 ' H ' ' C ' ' A' ' 18' ' ' TYR . 3.0 mt-10 -96.73 33.73 1.8 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.583 0.706 . . . . 0.0 110.324 179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.6 m 66.91 18.7 10.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.668 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.31 -92.72 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.856 -0.688 . . . . 0.0 113.157 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.405 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -109.89 -64.12 1.29 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.783 0.801 . . . . 0.0 112.179 -178.799 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.687 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 65.73 81.95 0.19 Allowed 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.561 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.556 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -51.07 -19.1 0.98 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.188 -178.42 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.515 ' O ' ' N ' ' A' ' 30' ' ' CYS . 23.5 m-85 -141.23 46.44 1.73 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.429 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -38.26 127.91 1.68 Allowed Glycine 0 C--N 1.334 0.47 0 CA-C-N 116.009 -0.542 . . . . 0.0 113.915 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 77.22 -23.88 0.24 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.01 0.433 . . . . 0.0 111.713 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.429 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.5 OUTLIER -124.01 19.72 9.18 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.885 -179.838 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.0 p -89.1 113.37 24.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -176.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.42 ' C ' ' CD1' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -110.46 -19.35 12.97 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.112 176.413 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.643 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 91.8 m-85 -160.69 -153.69 0.33 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.376 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.556 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 40.91 95.91 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.052 0.141 . . . . 0.0 111.092 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.687 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.66 -136.19 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -178.896 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.413 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -62.38 -104.05 0.01 OUTLIER Glycine 0 C--N 1.352 1.445 0 CA-C-N 118.672 0.669 . . . . 0.0 112.307 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.05 -130.21 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 178.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.775 ' HA2' HD11 ' A' ' 14' ' ' LEU . . . 100.09 -1.67 56.4 Favored Glycine 0 N--CA 1.437 -1.275 0 C-N-CA 120.299 -0.953 . . . . 0.0 114.726 177.625 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -87.51 32.55 0.71 Allowed 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.697 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.11 -20.16 38.65 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.925 0.393 . . . . 0.0 111.258 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.569 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -111.4 31.12 6.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.164 179.427 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 2.9 mm-40 -151.2 -54.76 0.14 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.005 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 60.22 114.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.181 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.82 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.467 ' O ' ' HB ' ' A' ' 5' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 120.652 0.263 . . . . 0.0 111.09 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.467 ' HB ' ' O ' ' A' ' 4' ' ' MET . 21.0 m 84.13 -39.96 0.07 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.023 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.6 p -145.15 -76.1 0.22 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.298 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 m 60.57 82.68 0.16 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.089 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m 55.72 33.21 20.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.662 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.409 ' HD2' HH12 ' A' ' 40' ' ' ARG . 0.0 OUTLIER -75.35 168.17 20.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.156 0.503 . . . . 0.0 110.647 -179.976 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.509 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.4 m-85 -75.35 -161.23 0.14 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.679 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.524 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -67.24 -164.81 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.167 0.508 . . . . 0.0 111.044 -178.478 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.579 ' CG2' ' HG3' ' A' ' 41' ' ' GLN . 1.1 t -117.79 -7.58 10.95 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.32 -178.579 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.757 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -79.72 -175.51 4.89 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.281 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.504 HD12 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -163.24 150.31 12.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.399 -178.771 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.582 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 8.6 t -71.96 81.66 0.93 Allowed 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.473 ' HG3' HD21 ' A' ' 14' ' ' LEU . 40.7 mtt-85 -75.69 -99.53 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.638 -179.087 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -74.75 -21.3 59.42 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.556 0.693 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.617 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -54.14 -45.48 71.98 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.653 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.73 -17.66 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.673 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.67 35.71 2.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.645 0.736 . . . . 0.0 110.175 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 m 69.0 12.39 8.6 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.415 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.557 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -63.01 -17.17 58.42 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.935 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.557 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 171.24 -68.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.713 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 4.0 m 64.3 83.83 0.16 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.358 -178.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 11.9 tpt180 -55.73 -13.75 1.88 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.931 -1.031 . . . . 0.0 112.104 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.675 ' CE2' ' HB1' ' A' ' 33' ' ' ALA . 20.3 m-85 -139.74 52.6 1.7 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.433 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.71 121.01 0.88 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 113.694 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 71.82 -17.12 0.36 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.97 0.508 . . . . 0.0 112.055 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -120.46 19.75 11.97 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.278 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.567 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.1 p -87.0 131.75 33.99 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.411 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.9 OUTLIER -128.1 -20.91 3.7 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.72 178.61 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.545 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 78.9 m-85 -155.71 -87.93 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.675 ' HB1' ' CE2' ' A' ' 26' ' ' TYR . . . -28.88 102.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.713 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -160.39 -137.29 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.653 -179.711 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.558 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -46.11 -103.53 0.01 OUTLIER Glycine 0 C--N 1.344 1.013 0 O-C-N 121.861 -0.524 . . . . 0.0 113.621 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.41 ' O ' ' CG ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -89.03 -92.53 0.12 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.523 -0.338 . . . . 0.0 110.435 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.757 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 57.05 68.97 1.42 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 114.552 0.581 . . . . 0.0 114.552 178.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.48 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 3.1 mt-10 -128.24 31.62 5.02 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 177.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.445 ' CD1' HD11 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -77.12 -8.4 57.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.246 -178.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.453 ' HG3' ' HA ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -124.2 18.42 9.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.189 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.579 ' HG3' ' CG2' ' A' ' 12' ' ' THR . 14.1 mm-40 -146.22 -26.49 0.43 Allowed 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.9 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.48 ' HB3' ' O ' ' A' ' 38' ' ' GLU . . . -45.59 128.46 8.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.098 0.475 . . . . 0.0 111.723 -179.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.357 -0.83 . . . . 0.0 110.707 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 40.1 mtt . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 120.803 0.335 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 t -76.12 115.95 16.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.0 110.01 22.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.993 0.425 . . . . 0.0 110.973 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.22 132.88 47.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.665 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.4 m 62.42 31.05 17.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.17 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.98 169.62 16.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.875 0.369 . . . . 0.0 110.15 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.624 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 4.0 m-85 -79.33 -159.76 0.21 Allowed 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.924 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -73.91 -164.56 0.23 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.192 0.52 . . . . 0.0 111.852 -177.132 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.588 ' OG1' ' HG3' ' A' ' 40' ' ' ARG . 3.9 t -125.09 41.35 3.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.745 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.538 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -131.7 -168.0 1.96 Allowed 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.52 ' N ' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -163.86 145.95 9.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.196 0.522 . . . . 0.0 111.787 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.606 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 24.6 t -71.55 81.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.243 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.501 ' HG3' HD22 ' A' ' 14' ' ' LEU . 9.7 mtp180 -75.44 -97.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -178.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.436 HG22 ' HD1' ' A' ' 18' ' ' TYR . 8.8 t -73.98 -20.86 60.21 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 121.706 0.765 . . . . 0.0 110.493 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.631 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.0 m-85 -52.93 -44.38 66.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.936 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 93.2 p -47.47 -18.21 0.12 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.381 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.16 33.01 2.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.583 0.706 . . . . 0.0 110.443 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.1 t 67.0 17.15 10.48 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.875 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.54 -25.95 69.24 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.887 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.08 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.747 0.784 . . . . 0.0 112.255 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.696 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 2.8 m 57.51 84.5 0.1 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.721 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.532 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.5 tpp180 -53.41 -17.02 1.64 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.849 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.624 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 23.0 m-85 -136.52 47.55 2.18 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.438 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -37.72 119.96 0.77 Allowed Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.898 -0.592 . . . . 0.0 114.115 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 82.5 -27.78 0.12 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.981 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -118.67 21.2 12.64 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.242 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.624 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 32.0 p -86.5 127.18 34.85 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -176.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.88 -20.62 5.35 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.968 -1.469 . . . . 0.0 109.676 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.624 ' CD1' ' HB3' ' A' ' 10' ' ' TYR . 97.1 m-85 -160.87 -160.89 0.78 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.899 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.532 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 45.07 95.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.633 178.539 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.696 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -159.44 -116.04 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.876 179.418 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.467 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -64.64 -119.8 0.01 OUTLIER Glycine 0 C--N 1.35 1.328 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.468 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 6.9 tp -69.45 -74.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.105 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.538 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 55.01 84.32 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.891 -0.595 . . . . 0.0 114.084 178.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.468 ' HG3' ' HG ' ' A' ' 36' ' ' LEU . 4.3 mt-10 -139.85 38.3 1.98 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.214 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.443 ' HA ' ' HB2' ' A' ' 43' ' ' ASN . 33.6 mt -62.09 -55.78 25.53 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.814 0.816 . . . . 0.0 110.476 -179.262 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.63 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -96.28 33.94 1.68 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.254 -1.339 . . . . 0.0 112.088 -179.796 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.63 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 12.2 mm-40 -153.77 15.7 0.5 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 120.652 0.263 . . . . 0.0 110.852 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -175.75 -36.75 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.208 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.443 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . 1.1 m-80 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.852 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.3 mtp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 120.8 0.334 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 p -112.14 -15.04 13.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.245 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.63 113.41 19.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.741 0.305 . . . . 0.0 110.716 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.6 13.8 22.51 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.431 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.58 -34.88 0.35 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.876 0.369 . . . . 0.0 111.072 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.435 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -63.93 163.57 11.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.145 0.498 . . . . 0.0 110.952 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.474 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 3.2 m-85 -84.58 -161.33 0.55 Allowed 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.493 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -72.43 -165.53 0.2 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.168 0.509 . . . . 0.0 112.051 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.592 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 3.3 t -127.78 44.46 2.93 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.465 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.595 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.1 mt-10 -126.92 177.54 6.55 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.201 -178.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.536 HD22 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -154.03 153.58 32.18 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.569 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 16.2 t -75.41 83.48 2.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.376 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.536 ' HG3' HD22 ' A' ' 14' ' ' LEU . 17.5 mtp180 -77.04 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.708 0.29 . . . . 0.0 111.768 -178.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -70.8 -21.27 62.49 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.49 0.662 . . . . 0.0 110.337 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.614 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -54.22 -47.91 71.65 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.656 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.2 -15.12 0.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.192 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.23 31.05 1.77 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.532 0.682 . . . . 0.0 110.67 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 m 71.41 18.29 5.57 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.955 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.64 -91.15 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.929 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.434 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -115.42 -60.86 1.82 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.052 0.93 . . . . 0.0 112.198 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.695 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 64.9 83.89 0.16 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.104 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.54 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 10.8 tpt180 -53.95 -16.85 2.08 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.698 -178.096 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.609 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.0 m-85 -138.16 51.25 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.448 ' O ' ' HB2' ' A' ' 28' ' ' ALA . . . -37.89 123.61 1.22 Allowed Glycine 0 CA--C 1.517 0.204 0 CA-C-N 115.91 -0.586 . . . . 0.0 113.492 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.448 ' HB2' ' O ' ' A' ' 27' ' ' GLY . . . 74.16 -19.52 0.35 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.172 0.589 . . . . 0.0 112.405 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.425 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -122.68 16.49 10.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.16 -179.528 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.609 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.0 p -80.54 131.45 35.54 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 122.169 0.985 . . . . 0.0 113.559 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.428 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -130.96 -16.96 3.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.252 179.347 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.474 ' CD1' ' HB3' ' A' ' 10' ' ' TYR . 88.1 m-85 -158.06 -85.0 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.527 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.701 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -34.43 109.01 0.07 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.082 -177.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.701 ' ND1' ' O ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -165.52 -134.08 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 O-C-N 123.259 0.349 . . . . 0.0 110.388 -179.425 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.451 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -50.7 -111.05 0.01 OUTLIER Glycine 0 C--N 1.355 1.59 0 CA-C-N 118.58 0.627 . . . . 0.0 113.027 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.491 HD21 HH11 ' A' ' 16' ' ' ARG . 1.8 tp -75.38 -82.95 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.595 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 68.62 95.87 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 121.036 -0.602 . . . . 0.0 113.362 178.536 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.576 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 4.7 mt-10 -139.86 32.41 2.0 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.079 -0.56 . . . . 0.0 110.637 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.414 HD23 HD13 ' A' ' 14' ' ' LEU . 1.8 mt -42.41 -32.1 0.49 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.125 0.488 . . . . 0.0 111.71 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.592 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -120.06 41.96 3.06 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.401 179.166 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.576 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 12.6 mm-40 -158.78 37.36 0.22 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.985 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 72.73 139.47 0.05 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.377 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 26.1 p30 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.086 179.92 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.8 0.333 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.4 p -122.58 -33.38 3.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.333 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.77 66.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.91 0.385 . . . . 0.0 110.865 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -70.81 171.06 11.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.171 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.97 -62.49 0.4 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.233 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.5 tpp180 -59.4 157.2 11.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.142 0.496 . . . . 0.0 110.763 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.479 ' CB ' ' CE1' ' A' ' 32' ' ' PHE . 3.9 m-85 -81.21 -162.71 0.52 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.746 -179.661 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.91 -167.15 0.35 Allowed 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.515 -178.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.621 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 2.1 t -119.87 13.99 12.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.583 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.558 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.9 mt-10 -96.53 -168.4 1.72 Allowed 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -178.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -168.99 153.54 5.67 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.441 0.639 . . . . 0.0 112.221 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.601 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.1 t -73.28 82.0 1.36 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.329 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.531 ' HG3' ' CD2' ' A' ' 14' ' ' LEU . 4.2 mtp85 -72.67 -98.47 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -178.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -75.4 -23.61 57.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.845 0.831 . . . . 0.0 110.086 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.594 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.1 -47.04 54.0 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.819 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.62 -11.31 0.05 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.834 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' ' 18' ' ' TYR . 1.3 mt-10 -97.6 33.03 2.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.585 0.707 . . . . 0.0 110.529 179.647 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.05 16.51 8.67 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.703 179.567 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -91.31 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.98 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.515 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -111.05 -63.96 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.957 0.884 . . . . 0.0 111.543 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.693 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 64.33 83.01 0.17 Allowed 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.98 -1.464 . . . . 0.0 109.382 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.515 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 2.2 tpt85 -50.92 -20.41 1.32 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.736 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.589 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 21.6 m-85 -142.39 55.92 1.44 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.674 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.85 -32.75 0.07 OUTLIER Glycine 0 N--CA 1.464 0.523 0 N-CA-C 115.677 1.031 . . . . 0.0 115.677 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.3 -17.04 13.25 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 118.337 1.068 . . . . 0.0 111.694 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.419 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.6 OUTLIER -126.08 25.9 6.63 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.226 -178.391 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.589 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 30.3 p -82.14 126.26 31.83 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.219 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -14.91 3.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.57 -1.65 . . . . 0.0 110.12 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.479 ' CE1' ' CB ' ' A' ' 10' ' ' TYR . 93.9 m-85 -158.83 -82.12 0.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.19 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.698 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -35.33 108.53 0.07 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.827 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.698 ' ND1' ' O ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -168.74 -136.74 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.05 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.456 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -50.52 -112.08 0.01 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.365 0.53 . . . . 0.0 113.469 179.555 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.414 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -76.68 -81.86 0.08 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.769 0.318 . . . . 0.0 110.271 -179.858 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.558 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 61.73 88.77 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 121.307 -0.473 . . . . 0.0 113.677 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 4.2 mt-10 -131.94 30.82 4.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.461 -0.37 . . . . 0.0 110.983 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.509 ' HG ' ' CD1' ' A' ' 14' ' ' LEU . 4.9 mt -39.1 -33.39 0.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.621 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -123.57 33.98 5.2 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.432 179.716 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.577 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 22.6 mm100 -160.45 61.84 0.32 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.443 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.78 -8.15 13.85 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.6 t30 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.169 -0.92 . . . . 0.0 110.77 179.767 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.0 ttt . . . . . 0 N--CA 1.489 1.483 0 CA-C-O 120.688 0.28 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.09 142.19 28.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.774 179.548 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.5 p -85.67 140.0 30.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.589 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.9 m -156.55 -53.68 0.08 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.26 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.2 p -93.98 46.55 1.18 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.545 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.97 179.14 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.473 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.447 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.2 m-85 -75.24 -164.02 0.28 Allowed 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.583 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.409 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -67.14 -163.72 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.184 0.516 . . . . 0.0 111.558 -178.417 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.492 HG23 ' HG3' ' A' ' 41' ' ' GLN . 5.1 t -137.11 31.64 2.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.775 -178.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.614 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.6 OUTLIER -123.25 -170.49 2.12 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.686 -178.605 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.772 HD22 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -169.47 157.59 7.39 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.067 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.635 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.3 t -75.31 83.08 2.43 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.347 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.772 ' HG2' HD22 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -74.98 -99.58 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.476 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 t -75.71 -22.93 56.14 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.89 0.852 . . . . 0.0 109.991 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.642 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -51.67 -45.37 63.39 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.05 -1.432 . . . . 0.0 111.735 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.0 t -49.2 -16.9 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.292 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -100.91 34.39 2.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.601 0.715 . . . . 0.0 110.502 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 15.58 10.15 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.081 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.569 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.19 -17.36 70.01 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 121.128 -0.558 . . . . 0.0 114.082 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.569 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 173.73 -71.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.605 0.717 . . . . 0.0 112.541 -178.975 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.712 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.32 80.39 0.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.653 -178.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 5.7 tpp85 -53.47 -16.94 1.65 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.378 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.557 ' O ' ' N ' ' A' ' 30' ' ' CYS . 20.6 m-85 -142.55 47.61 1.57 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.474 ' O ' ' HB1' ' A' ' 28' ' ' ALA . . . -36.82 128.49 1.09 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.122 -0.561 . . . . 0.0 113.494 -179.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.474 ' HB1' ' O ' ' A' ' 27' ' ' GLY . . . 73.38 -25.22 0.19 Allowed 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.434 ' H ' ' C ' ' A' ' 27' ' ' GLY . 9.1 ttpt -115.41 5.28 14.51 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.557 ' N ' ' O ' ' A' ' 26' ' ' TYR . 7.4 p -69.95 124.19 23.41 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -177.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.462 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -115.75 -22.34 9.19 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.398 -1.273 . . . . 0.0 109.408 178.895 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.462 ' CD1' ' O ' ' A' ' 31' ' ' GLN . 89.9 m-85 -159.97 -84.74 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.019 -179.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.623 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -27.03 104.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.398 0.679 . . . . 0.0 112.688 -178.457 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.712 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.56 -138.75 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.045 -179.704 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.555 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -44.15 -94.6 0.01 OUTLIER Glycine 0 C--N 1.346 1.131 0 CA-C-N 118.151 0.432 . . . . 0.0 113.636 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.504 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 0.6 OUTLIER -104.13 -85.68 0.46 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.542 . . . . 0.0 110.901 -178.801 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.753 ' CA ' HD21 ' A' ' 14' ' ' LEU . . . 63.29 88.71 0.04 OUTLIER Glycine 0 N--CA 1.44 -1.073 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.041 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.504 ' HG3' ' HG ' ' A' ' 36' ' ' LEU . 2.7 mt-10 -139.83 40.23 1.99 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.984 -0.608 . . . . 0.0 109.647 178.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.54 ' CD1' HD13 ' A' ' 14' ' ' LEU . 7.4 mt -76.33 -15.28 60.01 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.683 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.619 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -132.68 47.05 2.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.38 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.619 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 1.6 mm-40 -154.51 -67.28 0.13 Allowed 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 120.983 0.42 . . . . 0.0 110.816 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 66.43 11.04 7.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.525 -179.689 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 m120 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.832 179.83 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.531 ' O ' HG22 ' A' ' 5' ' ' THR . 1.5 mmt . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 120.601 0.238 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.531 HG22 ' O ' ' A' ' 4' ' ' MET . 0.5 OUTLIER -171.06 -80.09 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.198 179.686 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.4 p -109.59 87.86 2.61 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.932 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 26.2 p -85.66 1.78 47.95 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.674 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -169.04 -15.53 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.83 -171.27 0.17 Allowed 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 120.782 0.325 . . . . 0.0 110.689 -179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.545 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.6 m-85 -78.12 -158.09 0.12 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.704 -178.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -164.94 0.49 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.169 0.509 . . . . 0.0 110.741 -178.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.608 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 3.2 t -130.86 44.24 2.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.326 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.586 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.7 OUTLIER -121.98 -174.53 2.9 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.965 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.757 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -158.32 132.18 7.81 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.475 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.65 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 49.1 t -64.73 87.85 0.06 Allowed 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.727 ' HG3' HD21 ' A' ' 14' ' ' LEU . 32.5 mtp180 -83.91 -103.73 0.05 OUTLIER 'General case' 0 C--N 1.347 0.464 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -66.06 -23.54 66.55 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.932 0.872 . . . . 0.0 109.98 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.54 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.4 m-85 -51.81 -50.23 61.21 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.068 -1.424 . . . . 0.0 112.285 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.542 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 20.5 p -55.4 -35.43 65.32 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.772 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.7 tt0 -62.81 -41.23 99.21 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.976 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 13.2 p 152.94 13.52 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.203 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.12 -91.97 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.421 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.486 ' HE ' ' HD3' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -120.43 -63.08 1.39 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.971 0.891 . . . . 0.0 112.653 -178.046 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.72 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 70.64 79.67 0.17 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.154 -1.385 . . . . 0.0 108.698 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -54.4 -12.08 0.63 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.499 -178.635 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.559 ' CE2' ' HB1' ' A' ' 33' ' ' ALA . 12.3 m-85 -142.84 51.07 1.42 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -38.42 118.15 0.69 Allowed Glycine 0 CA--C 1.521 0.42 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.921 -178.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 79.98 -23.17 0.25 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.405 ' N ' ' O ' ' A' ' 26' ' ' TYR . 9.6 ttpt -118.27 13.69 13.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 14.3 p -77.73 130.77 37.17 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -176.757 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.03 -19.06 4.47 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.129 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.545 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 94.1 m-85 -158.79 -85.64 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.448 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.59 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -28.42 101.18 0.02 OUTLIER 'General case' 0 C--N 1.35 0.604 0 O-C-N 123.239 0.337 . . . . 0.0 110.987 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.72 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -167.05 -156.72 0.22 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.147 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.46 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -44.96 110.64 0.43 Allowed Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 116.481 -0.327 . . . . 0.0 113.231 178.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.505 ' CD2' ' HG3' ' A' ' 38' ' ' GLU . 0.9 OUTLIER 54.05 -92.13 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.541 -0.063 . . . . 0.0 111.075 179.107 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.633 ' HA2' HD23 ' A' ' 14' ' ' LEU . . . 66.15 94.61 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.715 0 CA-C-O 121.482 0.49 . . . . 0.0 113.905 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.505 ' HG3' ' CD2' ' A' ' 36' ' ' LEU . 3.5 mt-10 -138.59 43.22 2.14 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.388 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.603 ' CG ' HD12 ' A' ' 14' ' ' LEU . 2.0 mt -53.98 -25.59 21.68 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.863 0.363 . . . . 0.0 111.897 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.644 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -124.19 39.23 4.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.587 179.547 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 12.6 mm100 -159.18 46.01 0.28 Allowed 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.792 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.98 -80.82 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.722 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.184 -0.912 . . . . 0.0 111.099 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.884 0.373 . . . . 0.0 111.588 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.8 t -156.92 74.72 0.81 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.861 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.8 p -78.27 123.51 27.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.65 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 p -105.17 69.8 0.87 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.888 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 84.5 p -173.54 -52.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.049 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.424 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -63.91 164.01 11.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.11 0.481 . . . . 0.0 110.592 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.592 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.8 m-85 -74.43 -163.78 0.22 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.26 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -68.92 -167.61 0.11 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.365 0.602 . . . . 0.0 111.588 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.61 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 1.6 t -122.98 3.98 9.36 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.956 -178.833 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.65 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 0.6 OUTLIER -87.46 179.26 6.6 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.455 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.736 HD23 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -159.87 164.98 33.12 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 121.271 0.558 . . . . 0.0 111.929 -179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.586 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 37.6 t -86.82 80.47 8.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.136 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.549 ' HG2' HD21 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -74.6 -101.84 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.878 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.565 HG21 ' HD1' ' A' ' 18' ' ' TYR . 9.7 t -66.9 -19.05 65.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.44 0.638 . . . . 0.0 110.052 -179.656 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.687 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -60.3 -46.5 89.66 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.415 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -14.46 0.19 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.538 -179.191 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.17 32.97 2.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.482 0.658 . . . . 0.0 110.287 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.56 16.11 8.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.983 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.15 -91.03 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.704 -0.76 . . . . 0.0 113.095 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.63 -60.13 1.91 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.627 0.727 . . . . 0.0 111.928 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.732 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 63.64 77.76 0.31 Allowed 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.383 -1.28 . . . . 0.0 108.611 -178.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.422 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 3.5 tpt180 -49.81 -22.99 1.63 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.267 -178.064 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.564 ' O ' ' N ' ' A' ' 30' ' ' CYS . 21.1 m-85 -137.16 48.22 2.08 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.458 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.6 125.66 1.3 Allowed Glycine 0 CA--C 1.519 0.297 0 CA-C-N 115.896 -0.593 . . . . 0.0 114.197 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.458 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.06 -23.54 0.24 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 111.944 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -117.37 5.58 12.58 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.291 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 26' ' ' TYR . 16.8 p -71.48 125.08 26.11 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.658 0.742 . . . . 0.0 112.555 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.417 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -119.51 -18.49 8.45 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.829 179.566 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 96.9 m-85 -159.55 -79.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.978 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.637 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -37.88 110.91 0.14 Allowed 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.289 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.732 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.47 -121.1 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.069 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.421 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -56.09 -102.77 0.01 OUTLIER Glycine 0 C--N 1.356 1.661 0 O-C-N 122.011 -0.431 . . . . 0.0 113.255 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.493 HD13 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -94.15 -54.92 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.037 0.446 . . . . 0.0 110.275 179.863 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.736 ' HA2' HD23 ' A' ' 14' ' ' LEU . . . 54.68 24.43 32.51 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.653 178.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -83.79 37.01 0.57 Allowed 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.546 ' HG ' ' CD1' ' A' ' 14' ' ' LEU . 23.5 mt -43.88 -65.45 0.5 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.957 0.884 . . . . 0.0 111.077 179.236 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.659 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -85.82 36.2 0.65 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.582 -1.644 . . . . 0.0 111.727 -179.184 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.659 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 9.1 mm100 -158.33 70.53 0.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.75 0.31 . . . . 0.0 110.594 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.47 -7.96 11.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.053 179.815 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 120.795 0.331 . . . . 0.0 111.357 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.8 p -126.47 -69.74 0.75 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.637 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.9 p -127.9 32.39 4.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.531 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 m 53.47 22.51 2.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.206 179.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t 78.38 -16.76 0.63 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.02 164.7 0.21 Allowed 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.406 0.622 . . . . 0.0 111.469 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.452 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.7 m-85 -84.59 -161.15 0.53 Allowed 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.833 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.434 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 1.0 OUTLIER -68.64 -167.93 0.11 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.941 -178.426 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.656 ' HB ' ' HD2' ' A' ' 40' ' ' ARG . 6.2 t -119.36 -2.47 10.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.836 -178.73 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.581 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.6 OUTLIER -80.35 -168.88 1.85 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.913 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.544 HD22 ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -165.86 151.99 9.34 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.34 0.591 . . . . 0.0 112.339 -178.451 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.694 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 7.8 t -70.31 83.15 0.55 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.257 178.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.434 ' HG2' HD22 ' A' ' 14' ' ' LEU . 2.9 mmm-85 -77.29 -101.69 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.345 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 t -69.92 -23.32 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.771 0.796 . . . . 0.0 110.271 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.737 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -55.37 -44.57 76.18 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.685 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.9 t -46.59 -13.92 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.72 -179.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.404 ' H ' ' C ' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -93.58 30.95 1.63 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.493 0.663 . . . . 0.0 110.502 179.334 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.42 18.9 7.79 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.55 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.72 -90.65 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.932 -0.652 . . . . 0.0 113.639 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.426 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -113.12 -60.39 1.89 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.089 0.947 . . . . 0.0 112.219 -178.521 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.619 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 65.86 84.65 0.15 Allowed 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.854 -1.521 . . . . 0.0 108.116 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.522 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 0.0 OUTLIER -50.39 -17.77 0.53 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.241 -178.04 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.695 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 20.1 m-85 -136.67 51.21 2.0 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -37.83 120.43 0.85 Allowed Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 114.299 -178.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 75.39 -17.59 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.0 0.52 . . . . 0.0 112.048 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.425 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -125.13 19.8 8.27 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.446 -179.369 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.695 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.3 p -81.57 122.61 27.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -177.536 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -115.44 -19.96 10.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.946 -1.479 . . . . 0.0 109.298 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.452 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 90.8 m-85 -156.99 -128.9 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.201 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.581 ' O ' ' HB3' ' A' ' 13' ' ' GLU . . . 45.29 -157.49 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 121.138 0.494 . . . . 0.0 111.783 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.737 ' HA ' ' CE2' ' A' ' 18' ' ' TYR . 0.4 OUTLIER 78.71 -147.73 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.616 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.57 -161.26 0.51 Allowed Glycine 0 C--N 1.35 1.351 0 CA-C-O 121.237 0.354 . . . . 0.0 113.73 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.506 ' O ' HD21 ' A' ' 14' ' ' LEU . 5.8 tt -55.02 116.57 2.84 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.174 -0.513 . . . . 0.0 111.82 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.446 ' HA3' HD12 ' A' ' 14' ' ' LEU . . . -126.9 -106.63 1.44 Allowed Glycine 0 N--CA 1.439 -1.151 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.336 177.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 61.54 9.76 2.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 178.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.504 ' HG ' HD11 ' A' ' 14' ' ' LEU . 27.5 mt -38.9 -63.59 0.51 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.294 0.569 . . . . 0.0 112.216 -179.601 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.656 ' HD2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -79.45 24.7 0.35 Allowed 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.179 -179.528 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.587 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 3.3 mt-30 -155.64 70.53 0.72 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.871 0.367 . . . . 0.0 110.443 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -40.26 143.19 0.32 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.79 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.821 -179.989 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.762 0.315 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.8 t -83.59 129.56 34.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.882 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.4 p -85.08 147.16 26.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.42 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.88 44.62 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.475 179.566 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.5 p -176.09 -63.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.602 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.428 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER 67.3 157.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.216 0.531 . . . . 0.0 110.936 179.798 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.59 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.7 m-85 -80.64 -161.21 0.36 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.336 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.21 -167.03 0.37 Allowed 'General case' 0 N--CA 1.44 -0.925 0 CA-C-O 121.272 0.558 . . . . 0.0 111.178 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.535 HG22 ' HG3' ' A' ' 41' ' ' GLN . 3.3 t -127.38 19.72 6.83 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.103 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.739 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.2 mt-10 -100.99 -169.7 1.74 Allowed 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -178.733 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.667 ' CD2' ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -164.06 156.11 16.84 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.718 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.759 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 26.5 t -76.39 87.58 3.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.237 178.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.667 ' HG2' ' CD2' ' A' ' 14' ' ' LEU . 2.1 mmm-85 -74.9 -104.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.448 HG22 ' HD1' ' A' ' 18' ' ' TYR . 15.3 t -74.65 -17.09 60.74 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 121.76 0.79 . . . . 0.0 110.587 -179.491 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.598 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.6 m-85 -56.16 -42.3 76.8 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.12 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -25.6 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.934 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.461 ' O ' ' HB3' ' A' ' 21' ' ' SER . 0.0 OUTLIER -66.5 -44.08 83.59 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.445 179.456 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' A' ' 20' ' ' GLU . 33.8 p 153.09 19.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.072 179.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.99 -95.84 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.694 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.478 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -115.56 -58.27 2.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.909 0.862 . . . . 0.0 112.608 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.73 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.2 m 68.92 82.64 0.17 Allowed 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 113.736 -1.575 . . . . 0.0 107.535 -176.702 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.572 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 5.5 tpp85 -47.02 -21.0 0.17 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.418 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.624 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 21.0 m-85 -140.38 54.35 1.62 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.73 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.93 -30.23 0.04 OUTLIER Glycine 0 N--CA 1.467 0.744 0 N-CA-C 115.924 1.13 . . . . 0.0 115.924 -177.167 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -114.17 -12.7 12.47 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.988 0.894 . . . . 0.0 111.283 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.436 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -131.61 31.08 4.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.525 -178.574 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.624 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 30.8 p -86.01 108.68 18.34 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -15.16 13.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.022 -1.444 . . . . 0.0 108.335 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.59 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 96.3 m-85 -157.28 -133.21 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.205 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.598 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 45.8 -156.34 0.03 OUTLIER 'General case' 0 N--CA 1.458 -0.071 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.759 ' CD2' ' HA ' ' A' ' 15' ' ' CYS . 0.3 OUTLIER 76.9 -165.36 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.882 179.573 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 36' ' ' LEU . . . -59.11 108.24 1.53 Allowed Glycine 0 C--N 1.34 0.778 0 CA-C-N 115.84 -0.618 . . . . 0.0 113.507 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.501 ' O ' ' O ' ' A' ' 35' ' ' GLY . 3.1 tt 51.41 161.09 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.756 0.789 . . . . 0.0 111.557 178.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.739 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 162.6 97.58 0.12 Allowed Glycine 0 N--CA 1.433 -1.544 0 CA-C-N 115.124 -0.944 . . . . 0.0 113.019 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.442 ' HB3' ' H ' ' A' ' 42' ' ' ALA . 1.8 mt-10 -140.53 43.46 1.87 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.492 HD13 HD13 ' A' ' 14' ' ' LEU . 1.1 mt -70.17 -12.86 61.9 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.856 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.588 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -131.03 29.64 4.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.024 -179.786 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.588 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 26.4 mm-40 -153.34 -58.61 0.13 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.159 0.504 . . . . 0.0 111.392 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.442 ' H ' ' HB3' ' A' ' 38' ' ' GLU . . . 60.47 113.2 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.914 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.291 -0.861 . . . . 0.0 110.826 -179.72 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.6 ppp? . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.9 p -64.33 124.92 22.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.446 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.534 HG23 ' H ' ' A' ' 7' ' ' SER . 0.4 OUTLIER -136.05 -68.87 0.49 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.716 179.388 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.534 ' H ' HG23 ' A' ' 6' ' ' THR . 16.8 m 53.51 17.05 1.04 Allowed 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.91 -49.06 0.11 Allowed 'General case' 0 C--N 1.335 -0.052 0 CA-C-O 120.877 0.37 . . . . 0.0 111.166 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.37 151.15 28.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.058 -179.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.576 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.9 m-85 -85.16 -163.16 0.79 Allowed 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.475 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.586 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 18.9 mttt -67.64 -162.88 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 121.6 0.714 . . . . 0.0 111.344 -179.105 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.497 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 3.4 t -126.75 1.99 6.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.901 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.713 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -82.62 -169.11 2.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.529 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.794 HD22 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -162.2 155.23 20.21 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.811 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.705 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 36.0 t -77.72 85.27 4.03 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.794 ' HG2' HD22 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -71.48 -101.74 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.158 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 t -77.07 -23.12 51.97 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.001 0.905 . . . . 0.0 110.076 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.564 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -47.33 -51.39 19.53 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.277 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.78 -12.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.414 ' H ' ' C ' ' A' ' 18' ' ' TYR . 0.3 OUTLIER -98.08 34.66 1.89 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.508 0.671 . . . . 0.0 110.347 179.398 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.32 16.65 9.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.359 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.2 -90.9 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.809 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.47 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -112.2 -65.33 1.19 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.585 0.707 . . . . 0.0 111.685 -179.102 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 64.82 81.8 0.2 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.024 -178.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.596 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 4.9 tpp85 -55.6 -13.61 1.69 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.049 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.77 ' CE2' ' HB2' ' A' ' 33' ' ' ALA . 15.5 m-30 -139.63 52.3 1.72 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -38.26 117.41 0.59 Allowed Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.114 -0.565 . . . . 0.0 114.333 -178.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 78.95 -18.32 0.52 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.6 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -121.27 10.24 10.57 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.797 -179.16 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.563 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 16.5 p -74.66 130.94 40.43 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -177.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.461 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -132.21 -14.76 2.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.092 177.954 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.586 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 97.1 m-85 -158.89 -81.77 0.05 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.77 ' HB2' ' CE2' ' A' ' 26' ' ' TYR . . . -37.29 102.56 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 111.192 -177.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.48 -154.99 0.22 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.327 -179.062 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.551 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -62.69 97.63 0.19 Allowed Glycine 0 CA--C 1.496 -1.135 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 178.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 59.21 164.18 0.05 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.336 0.589 . . . . 0.0 110.129 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.713 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 159.16 101.05 0.17 Allowed Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 120.17 -1.014 . . . . 0.0 113.187 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 2.9 mt-10 -136.18 45.89 2.33 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.199 -0.5 . . . . 0.0 110.271 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.597 HD13 HD11 ' A' ' 14' ' ' LEU . 1.5 mt -57.05 -20.48 24.95 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.54 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.549 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -133.63 42.81 2.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.36 179.666 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.471 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 47.9 mt-30 -157.3 -49.29 0.07 Allowed 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.427 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 171.59 84.39 0.0 OUTLIER 'General case' 0 C--O 1.231 0.081 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.147 -179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.301 -0.856 . . . . 0.0 111.035 -179.755 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.8 mtt . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.766 0.317 . . . . 0.0 111.29 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.3 m -67.91 157.38 35.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.995 -179.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.455 ' O ' ' HB3' ' A' ' 7' ' ' SER . 0.7 OUTLIER -121.37 -5.45 9.35 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -179.633 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.455 ' HB3' ' O ' ' A' ' 6' ' ' THR . 23.3 t 74.54 -67.59 0.25 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.72 0.295 . . . . 0.0 111.14 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.4 m -156.05 89.66 1.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.644 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.411 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 19.0 tpp180 -72.71 161.74 30.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 0.0 111.314 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.505 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.2 m-85 -72.82 -162.77 0.11 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.304 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -162.83 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.022 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.575 ' CG2' ' HG3' ' A' ' 41' ' ' GLN . 3.4 t -132.92 24.85 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.365 -178.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.499 ' OE2' ' HA ' ' A' ' 33' ' ' ALA . 0.2 OUTLIER -118.93 177.6 4.8 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -178.785 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.611 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -159.51 142.03 13.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.137 0.494 . . . . 0.0 112.205 -177.454 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.517 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.0 t -69.18 82.61 0.35 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.897 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.611 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -75.95 -99.62 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.704 0.288 . . . . 0.0 111.66 -178.96 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.4 HG23 ' HD1' ' A' ' 18' ' ' TYR . 11.4 t -72.97 -23.94 60.72 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.728 0.775 . . . . 0.0 109.974 179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.557 ' CE1' ' CA ' ' A' ' 35' ' ' GLY . 3.0 m-85 -50.22 -47.15 55.01 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.923 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 p -49.12 -18.14 0.29 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.559 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.12 33.04 2.74 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.585 0.707 . . . . 0.0 110.62 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.99 17.28 8.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.292 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . 0.493 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.54 -19.8 73.18 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.725 -179.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.493 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 175.68 -69.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.716 0.769 . . . . 0.0 112.257 -179.259 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.712 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.7 m 64.26 81.48 0.21 Allowed 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.445 -1.252 . . . . 0.0 109.643 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.531 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.9 tpt180 -49.71 -19.46 0.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.112 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.568 ' O ' ' N ' ' A' ' 30' ' ' CYS . 24.2 m-85 -143.18 43.4 1.54 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.504 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.37 134.5 0.94 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.207 -0.52 . . . . 0.0 113.823 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 72.53 -24.67 0.19 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.996 0.427 . . . . 0.0 111.657 -178.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.504 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -121.54 10.71 10.48 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.349 -179.001 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.568 ' N ' ' O ' ' A' ' 26' ' ' TYR . 25.6 p -79.8 118.67 21.8 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.473 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -110.34 -24.27 10.73 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.431 -1.258 . . . . 0.0 108.094 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.505 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 89.4 m-85 -161.14 -151.37 0.23 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.376 -1.284 . . . . 0.0 108.916 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.541 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 41.51 95.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 110.486 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.712 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.0 -143.22 0.06 Allowed 'General case' 0 CA--C 1.555 1.151 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.826 -177.88 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.557 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -63.94 118.95 14.38 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 122.171 -0.33 . . . . 0.0 113.248 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.3 tt 46.55 -91.48 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 178.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.449 ' CA ' HD12 ' A' ' 14' ' ' LEU . . . 52.16 77.71 0.13 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.619 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -129.58 42.95 3.21 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.235 -0.482 . . . . 0.0 109.727 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.547 ' CD1' HD11 ' A' ' 14' ' ' LEU . 3.2 mt -76.08 -13.56 60.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.622 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.451 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -130.26 24.04 5.2 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.722 179.761 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.575 ' HG3' ' CG2' ' A' ' 12' ' ' THR . 6.4 mm-40 -145.98 -45.32 0.2 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.126 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 62.97 165.37 0.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.712 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.934 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.1 mtm . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.663 0.268 . . . . 0.0 111.517 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m -71.08 160.44 32.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.849 0.357 . . . . 0.0 110.738 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.451 ' O ' ' HB2' ' A' ' 7' ' ' SER . 17.7 p -137.48 23.45 2.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.107 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 6' ' ' THR . 70.9 m 71.5 -83.29 0.03 OUTLIER 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.71 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.3 p -161.76 34.88 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.723 0.297 . . . . 0.0 111.047 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.406 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 3.4 tpp85 -84.18 158.46 21.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.076 0.465 . . . . 0.0 110.47 -179.882 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.445 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.1 m-85 -71.56 -163.42 0.1 Allowed 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.405 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -61.79 -164.74 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.109 -178.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.534 ' OG1' ' HG3' ' A' ' 40' ' ' ARG . 6.6 t -134.11 36.4 3.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.637 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.542 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -127.52 -175.2 3.39 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 -178.825 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.639 HD13 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -169.04 148.4 4.07 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-O 121.189 0.518 . . . . 0.0 112.181 -179.24 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.587 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 15.2 t -69.42 78.22 0.39 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.507 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 8.8 mtt-85 -68.77 -95.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.8 t -77.91 -22.1 50.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.839 0.828 . . . . 0.0 110.257 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.713 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.4 m-85 -50.7 -43.49 57.78 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.494 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.4 p -56.3 -38.0 70.66 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.523 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -57.01 -47.56 80.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.223 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.523 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 0.3 OUTLIER 156.24 30.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.518 179.684 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.79 -96.49 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.954 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.413 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -120.12 -52.0 2.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.016 0.912 . . . . 0.0 111.755 -179.017 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.736 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 62.79 76.47 0.36 Allowed 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.835 -1.529 . . . . 0.0 108.281 -177.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 5.8 tpt180 -46.93 -21.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.375 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.565 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 27.7 m-85 -139.8 42.96 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.086 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.457 ' CA ' ' HB3' ' A' ' 24' ' ' CYS . . . -37.99 126.63 1.52 Allowed Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.937 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.421 ' CB ' ' O ' ' A' ' 27' ' ' GLY . . . 86.03 -35.48 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.007 0.523 . . . . 0.0 111.874 -179.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 ttpt -114.81 9.27 16.25 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.052 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.565 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.2 p -72.5 116.12 12.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -176.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.415 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -109.24 -21.97 12.3 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.114 177.074 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.445 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 86.2 m-85 -160.96 -157.49 0.52 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.553 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.606 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 41.94 102.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 178.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.736 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -165.28 -111.61 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.717 179.222 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.414 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -69.46 -119.71 0.03 OUTLIER Glycine 0 C--N 1.349 1.293 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -70.14 -73.6 0.16 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.943 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.639 ' HA2' HD13 ' A' ' 14' ' ' LEU . . . 58.79 91.57 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.263 178.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.44 ' HG3' ' HG ' ' A' ' 36' ' ' LEU . 3.0 mt-10 -134.24 46.45 2.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.211 -0.495 . . . . 0.0 110.558 179.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.454 ' HG ' ' CD1' ' A' ' 14' ' ' LEU . 4.2 mt -55.92 -19.96 14.12 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.534 ' HG3' ' OG1' ' A' ' 12' ' ' THR . 0.1 OUTLIER -141.35 24.56 2.1 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.187 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.407 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 8.7 mm-40 -144.14 11.92 1.57 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.417 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -87.73 37.4 0.79 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.764 0.316 . . . . 0.0 111.772 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.2 t30 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.291 -0.861 . . . . 0.0 110.888 179.805 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.6 mtt . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 120.896 0.379 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.9 m 73.25 -63.54 0.43 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.332 179.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.7 p -130.68 -52.96 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.953 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 t 59.23 23.6 11.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.578 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.29 -65.22 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.741 0.305 . . . . 0.0 111.464 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.12 158.93 35.01 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.154 0.502 . . . . 0.0 110.759 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.555 ' HB3' ' CE2' ' A' ' 32' ' ' PHE . 3.9 m-85 -74.95 -164.12 0.27 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.179 -179.445 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.456 ' HE3' ' HE2' ' A' ' 26' ' ' TYR . 9.3 mttm -66.57 -165.85 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.267 0.556 . . . . 0.0 111.355 -178.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.586 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 4.3 t -127.83 5.67 6.05 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.134 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.619 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 1.4 mt-10 -87.08 -176.47 5.72 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.137 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.722 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -160.9 149.4 16.26 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.379 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.598 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.2 t -72.49 86.32 1.16 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.71 178.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.722 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.11 -100.76 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -178.614 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.43 HG23 ' HD1' ' A' ' 18' ' ' TYR . 14.0 t -71.33 -23.19 61.89 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.702 0.763 . . . . 0.0 110.234 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.565 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.14 -50.12 49.78 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 114.595 -1.184 . . . . 0.0 112.181 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.463 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 88.8 p -56.01 -28.03 55.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.945 0.402 . . . . 0.0 112.058 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.518 ' O ' ' HB2' ' A' ' 21' ' ' SER . 2.2 tt0 -74.15 -39.81 63.03 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.91 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.518 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 35.0 t 159.36 10.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.536 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.48 -88.53 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.729 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -138.11 -57.81 0.66 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.144 0.973 . . . . 0.0 112.154 -178.123 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.723 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 74.22 77.37 0.12 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 113.217 -1.81 . . . . 0.0 108.381 -177.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 18.9 tpp180 -49.11 -16.92 0.17 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.725 -178.224 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.508 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 21.9 m-85 -142.95 48.96 1.48 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.446 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.61 126.66 1.79 Allowed Glycine 0 C--N 1.332 0.355 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.737 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.06 -18.44 0.44 Allowed 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 123.077 0.551 . . . . 0.0 112.202 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.79 17.88 6.79 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.57 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.508 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 23.7 p -85.01 115.61 22.93 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -177.114 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -112.09 -19.78 12.18 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.192 176.553 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.555 ' CE2' ' HB3' ' A' ' 10' ' ' TYR . 86.6 m-85 -160.75 -157.82 0.56 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.563 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.551 ' H ' ' HB2' ' A' ' 13' ' ' GLU . . . 42.34 98.25 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.143 0.177 . . . . 0.0 110.556 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.723 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.15 -142.23 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -178.241 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.515 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -56.87 -91.09 0.01 OUTLIER Glycine 0 C--N 1.35 1.329 0 N-CA-C 111.664 -0.575 . . . . 0.0 111.664 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.496 ' HB3' HD22 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -78.71 -152.53 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.409 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.619 ' CA ' ' HA ' ' A' ' 13' ' ' GLU . . . 137.29 -0.03 2.78 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 119.615 -1.279 . . . . 0.0 114.12 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -71.42 35.01 0.05 Allowed 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.544 -0.463 . . . . 0.0 111.89 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.502 ' HG ' ' CD1' ' A' ' 14' ' ' LEU . 41.9 mt -48.13 -69.38 0.12 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.54 0.686 . . . . 0.0 111.37 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.586 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.1 OUTLIER -75.91 20.71 0.18 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.528 -179.019 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.468 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 11.8 mt-30 -150.58 79.39 1.33 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 122.797 0.439 . . . . 0.0 110.466 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -44.71 146.45 0.76 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.731 0.301 . . . . 0.0 111.455 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 30.5 p30 . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.006 -179.929 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.869 0.366 . . . . 0.0 110.946 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -159.17 -68.0 0.08 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.096 -179.844 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.8 p -90.55 94.7 9.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.953 -179.882 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.36 113.44 25.32 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.85 179.924 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.6 m 59.21 89.74 0.06 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.778 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . 0.555 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 10.7 tpp85 -77.71 155.69 31.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.421 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.582 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.0 m-85 -68.54 -159.21 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.249 -179.344 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . 0.481 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -72.94 -164.03 0.15 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.865 -178.223 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 t -129.83 31.06 4.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.991 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.481 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.4 mt-10 -125.06 -167.52 1.69 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.218 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.522 ' N ' HD21 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -166.25 155.88 11.79 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 112.061 -178.414 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.6 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.9 t -72.35 78.8 1.01 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.25 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.473 ' HG2' HD23 ' A' ' 14' ' ' LEU . 4.8 mmm180 -70.27 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.021 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.8 t -71.47 -20.65 62.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.668 0.746 . . . . 0.0 110.626 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.626 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -55.25 -47.05 75.98 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.798 -179.181 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -13.21 0.06 Allowed 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.282 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.41 31.49 1.97 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.625 0.726 . . . . 0.0 110.565 179.401 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.5 t 70.55 17.43 6.74 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.841 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -92.41 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.784 -0.722 . . . . 0.0 113.128 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.98 -61.78 1.64 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.982 0.896 . . . . 0.0 111.899 -178.999 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.73 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 63.71 81.39 0.21 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.046 -1.434 . . . . 0.0 108.684 -177.877 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.562 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -52.51 -19.87 2.55 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.285 -178.401 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.569 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.2 m-85 -137.36 49.55 2.0 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.149 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.41 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.82 119.98 0.8 Allowed Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.174 -0.467 . . . . 0.0 113.808 -179.188 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 77.14 -20.53 0.37 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 122.652 0.381 . . . . 0.0 111.627 -179.38 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.473 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -118.95 15.38 13.36 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.927 179.891 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 24.9 p -83.97 130.91 34.88 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.013 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -128.26 -18.38 4.09 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.056 -1.429 . . . . 0.0 110.201 178.763 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.582 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 95.3 m-85 -158.16 -74.48 0.09 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.644 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.685 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -41.43 105.12 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.796 -177.162 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.73 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.53 -133.33 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.732 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.47 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -68.64 -118.7 0.03 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.584 0.629 . . . . 0.0 111.736 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.495 ' O ' HD21 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -70.89 -170.17 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.286 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.481 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 160.63 -84.64 0.12 Allowed Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.457 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.525 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 10.2 mt-10 39.55 26.96 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 179.423 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.47 ' CD1' HD13 ' A' ' 14' ' ' LEU . 1.5 mt -41.58 -37.4 1.12 Allowed 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.05 0.453 . . . . 0.0 111.822 -179.923 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.485 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -112.49 37.87 2.92 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.666 -179.236 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.525 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 5.0 mt-30 -146.59 -56.17 0.27 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.322 179.468 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 60.3 131.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.949 0.404 . . . . 0.0 111.351 -179.574 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . 0.446 ' HB2' ' OE1' ' A' ' 38' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.603 179.776 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.792 0.33 . . . . 0.0 111.167 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.7 m 56.98 73.65 0.45 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.872 -179.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.9 t -72.67 145.19 47.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.974 -179.83 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.93 -19.19 18.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.029 179.849 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -151.96 -46.72 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.62 179.901 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 68.7 174.8 0.28 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.412 -179.815 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.419 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.7 m-85 -71.5 -163.37 0.09 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.615 -179.974 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -68.07 -172.99 0.34 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.46 0.648 . . . . 0.0 112.037 -177.965 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.09 -22.32 11.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.469 -178.445 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.724 ' O ' ' HD2' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -79.4 -178.78 6.43 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.164 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.575 HD11 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -166.25 150.31 7.69 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.067 -178.582 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.606 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 9.2 t -67.74 77.48 0.2 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.454 ' HG2' ' CD2' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -67.02 -95.35 0.0 OUTLIER 'General case' 0 C--N 1.344 0.334 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 -178.896 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -80.39 -23.07 40.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 121.819 0.818 . . . . 0.0 110.054 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -48.42 -44.95 35.64 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.338 -1.301 . . . . 0.0 111.632 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.93 -11.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.71 32.77 1.37 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.536 0.684 . . . . 0.0 110.341 179.432 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m 65.45 28.65 11.56 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.664 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.06 -97.46 0.1 OUTLIER Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 116.048 -0.524 . . . . 0.0 113.062 -179.561 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.09 -58.59 1.86 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.719 0.771 . . . . 0.0 111.851 -179.155 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.704 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 58.04 81.04 0.16 Allowed 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.177 -177.825 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.474 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 6.6 tpm_? -51.64 -18.49 1.19 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.148 -178.738 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.522 ' O ' ' N ' ' A' ' 30' ' ' CYS . 25.9 m-85 -139.71 44.92 1.93 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.487 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.476 ' O ' ' HB1' ' A' ' 28' ' ' ALA . . . -37.91 128.88 1.54 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.804 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.476 ' HB1' ' O ' ' A' ' 27' ' ' GLY . . . 75.37 -24.49 0.22 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.051 -179.6 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . 0.418 ' H ' ' C ' ' A' ' 27' ' ' GLY . 5.1 ttpt -121.45 15.97 11.27 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.771 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.2 p -87.16 114.37 23.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -176.475 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.427 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -110.14 -19.12 13.15 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.769 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.724 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 86.5 m-85 -160.66 -160.99 0.8 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.896 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.59 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 46.58 98.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.73 178.754 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.704 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.21 -111.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.81 179.369 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.424 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -73.45 -127.37 0.12 Allowed Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 -179.62 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.402 ' HG ' ' H ' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -60.44 -74.68 0.07 Allowed 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.219 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 53.88 18.61 8.83 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.842 178.845 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.402 ' H ' ' HG ' ' A' ' 36' ' ' LEU . 7.1 mt-10 -92.6 43.19 1.12 Allowed 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.788 0.328 . . . . 0.0 110.218 179.157 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.465 ' CD1' HD13 ' A' ' 14' ' ' LEU . 4.5 mt -84.74 -20.52 30.98 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.427 -179.815 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.76 36.83 4.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.145 179.377 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -148.52 -23.82 0.33 Allowed 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.59 -179.741 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 68.18 125.25 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.931 0.396 . . . . 0.0 111.234 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.831 179.955 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 ttt . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 120.785 0.326 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.76 162.43 21.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.73 179.961 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.42 ' O ' ' HB2' ' A' ' 7' ' ' SER . 12.6 p -106.97 -28.28 10.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.12 -179.842 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.42 ' HB2' ' O ' ' A' ' 6' ' ' THR . 1.4 m 68.83 -63.94 0.34 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.903 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.9 p -169.05 43.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.371 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.68 177.02 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.939 -179.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . 0.549 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.8 m-85 -79.89 -162.73 0.46 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.784 179.898 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.21 -167.85 0.13 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.281 0.563 . . . . 0.0 111.701 -178.468 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.431 HG23 ' CG ' ' A' ' 41' ' ' GLN . 0.3 OUTLIER -119.12 -8.86 10.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.635 -178.711 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.649 ' O ' ' HD2' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -81.95 -174.87 5.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.177 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.65 ' CD2' ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -167.98 154.86 7.93 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 121.043 0.449 . . . . 0.0 111.506 -178.825 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' CYS . . . . . 0.599 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.8 t -72.47 83.31 1.09 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.226 179.541 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.65 ' HG3' ' CD2' ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.86 -101.09 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -178.345 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -70.89 -20.35 62.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.783 0.801 . . . . 0.0 109.862 179.603 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.708 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -55.53 -48.02 75.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.659 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.6 t -45.88 -27.85 0.97 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.242 -178.897 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.595 ' O ' ' CB ' ' A' ' 21' ' ' SER . 0.7 OUTLIER -76.3 -31.89 58.45 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.067 -179.802 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.595 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 10.7 t 138.31 2.43 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.998 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.78 -38.5 10.06 Favored Glycine 0 C--N 1.332 0.311 0 N-CA-C 114.726 0.651 . . . . 0.0 114.726 -178.899 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.47 -62.35 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.703 0.763 . . . . 0.0 112.611 -178.396 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.695 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 65.64 80.88 0.22 Allowed 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.133 -1.394 . . . . 0.0 109.096 -177.72 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.408 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 tpm_? -50.25 -21.23 1.28 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.733 -179.319 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' TYR . . . . . 0.578 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 24.9 m-85 -140.62 55.07 1.59 Allowed 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.285 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . 0.656 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.64 -35.39 0.12 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 115.61 1.004 . . . . 0.0 115.61 -177.224 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.69 -18.48 13.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 118.167 0.983 . . . . 0.0 112.085 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.22 28.52 6.02 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.952 -178.162 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' CYS . . . . . 0.578 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 31.8 p -87.24 116.85 25.6 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -177.549 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.488 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -120.42 -14.02 8.76 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.945 178.585 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.649 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.9 m-85 -158.33 -85.88 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -178.959 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.583 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -34.9 109.55 0.08 Allowed 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -177.84 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.708 ' CG ' ' CD2' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -162.95 -112.06 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.287 178.415 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.472 ' HA2' ' CE1' ' A' ' 18' ' ' TYR . . . -58.41 -100.15 0.01 OUTLIER Glycine 0 C--N 1.348 1.226 0 N-CA-C 112.728 -0.149 . . . . 0.0 112.728 -179.237 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' LEU . . . . . 0.407 HD12 ' CD ' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -116.3 -42.13 3.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.838 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.619 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 37.66 72.09 0.19 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.847 179.478 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -119.12 41.06 3.16 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.955 -0.623 . . . . 0.0 110.227 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.474 ' CD1' HD13 ' A' ' 14' ' ' LEU . 52.9 mt -72.05 -31.36 66.07 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.472 0.653 . . . . 0.0 110.691 -179.88 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.486 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -119.51 45.35 2.15 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.729 179.813 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.486 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 1.9 mm-40 -146.78 -17.39 0.42 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.091 -179.929 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 66.79 166.23 0.21 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.815 0.34 . . . . 0.0 111.045 -179.654 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 m120 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.85 -179.926 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.444 -0.735 0 CA-C-O 121.302 0.572 . . . . 0.0 111.266 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.0 t -119.87 1.0 10.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.191 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.564 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -81.57 -173.74 4.57 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.384 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.806 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -161.12 147.92 14.94 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.857 -179.362 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.638 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 18.8 t -72.34 85.9 1.11 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.806 ' HG3' HD23 ' A' ' 14' ' ' LEU . 1.1 mtp85 -78.07 -101.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -71.66 -21.48 61.81 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.737 0.78 . . . . 0.0 110.047 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.592 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -52.99 -48.07 67.76 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.493 -1.231 . . . . 0.0 112.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.12 -12.8 0.09 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.843 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.39 32.96 2.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.473 0.654 . . . . 0.0 110.6 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 70.02 15.11 7.78 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.689 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.0 -88.62 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.954 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -114.93 -64.45 1.31 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.843 0.83 . . . . 0.0 112.153 -178.725 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.17 83.97 0.16 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.711 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.589 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 16.2 tpt85 -55.36 -14.1 1.72 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.439 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.699 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.7 m-85 -139.2 51.91 1.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.098 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.49 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.4 118.81 0.76 Allowed Glycine 0 CA--C 1.52 0.401 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.943 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.7 -14.97 0.73 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.736 0.414 . . . . 0.0 111.967 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.474 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -124.94 17.09 8.57 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.273 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.651 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 27.3 p -84.3 132.59 34.6 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.143 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.418 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -131.17 -17.36 3.05 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.65 -1.613 . . . . 0.0 110.38 178.827 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.487 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 82.8 m-85 -157.75 -85.79 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.699 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -33.26 105.57 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -177.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -161.99 -139.67 0.05 Allowed 'General case' 0 CA--C 1.557 1.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 -179.325 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -50.68 -113.53 0.01 OUTLIER Glycine 0 C--N 1.348 1.218 0 CA-C-N 118.118 0.417 . . . . 0.0 114.015 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.14 -75.19 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.96 0.409 . . . . 0.0 111.436 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.564 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.447 -0.582 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.864 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.465 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.459 0 CA-C-O 120.956 0.407 . . . . 0.0 110.965 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.9 t -127.84 2.61 6.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.208 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.664 ' CG ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -86.67 -174.03 4.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.454 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.59 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -169.01 156.51 7.32 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.554 0.692 . . . . 0.0 112.571 -179.201 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.658 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 5.1 t -71.17 84.02 0.73 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.692 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.523 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -70.04 -97.71 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.822 0.344 . . . . 0.0 111.504 -179.109 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -81.59 -19.82 41.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 122.055 0.931 . . . . 0.0 110.171 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.715 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -50.61 -51.12 51.61 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.388 -1.278 . . . . 0.0 112.567 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.11 -32.29 22.16 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.897 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.458 ' O ' ' CB ' ' A' ' 21' ' ' SER . 3.7 tt0 -68.16 -40.89 82.21 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.113 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 0.4 OUTLIER 158.64 18.63 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.93 -90.76 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 121.386 -0.435 . . . . 0.0 113.735 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 1.3 ttt180 -133.36 -57.15 0.9 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.123 0.963 . . . . 0.0 112.272 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.72 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 72.46 79.85 0.15 Allowed 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.369 -1.741 . . . . 0.0 108.531 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 12.0 tpt180 -50.96 -16.91 0.49 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.441 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.522 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 18.1 m-85 -140.91 49.9 1.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.83 126.02 1.42 Allowed Glycine 0 C--N 1.335 0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.212 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 70.96 -14.35 0.45 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.14 -0.53 . . . . 0.0 112.219 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -127.85 17.58 6.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 122.688 0.395 . . . . 0.0 111.299 -179.542 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' TYR . 26.6 p -87.37 107.28 18.46 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.507 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -103.67 -16.86 15.35 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.046 176.283 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.507 ' N ' ' OE1' ' A' ' 31' ' ' GLN . 97.6 m-85 -153.71 -138.79 0.08 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.793 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.665 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 51.75 -158.94 0.11 Allowed 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.334 -0.229 . . . . 0.0 111.093 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.72 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER 83.59 -147.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 178.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -61.39 -132.42 0.01 OUTLIER Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.262 0.465 . . . . 0.0 114.262 -178.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -37.22 -77.12 0.02 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.656 -0.772 . . . . 0.0 111.502 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.664 ' HA3' ' CG ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 121.275 -0.488 . . . . 0.0 113.937 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.444 -0.747 0 CA-C-O 121.06 0.457 . . . . 0.0 110.765 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -121.67 -3.92 9.25 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.447 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.804 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -79.91 -170.45 2.44 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.93 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.64 HD22 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -166.06 144.84 5.88 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.337 0.589 . . . . 0.0 111.899 -179.089 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.64 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -71.16 84.73 0.74 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.537 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.688 ' CD ' HD11 ' A' ' 36' ' ' LEU . 3.8 mtp180 -79.48 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -71.34 -18.91 62.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.548 0.689 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.692 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.8 m-85 -53.55 -48.08 69.44 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.943 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.52 -36.77 7.07 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.18 0.514 . . . . 0.0 111.747 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.526 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.6 tt0 -67.73 -38.17 83.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 14.4 t 150.53 -0.72 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.718 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -43.25 -41.11 4.85 Favored Glycine 0 C--N 1.332 0.342 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -178.26 -60.27 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.463 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 67.26 80.78 0.21 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.661 -176.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.613 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 3.9 tpp180 -52.52 -18.72 1.84 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.674 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.91 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 23.6 m-85 -137.09 49.76 2.02 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.09 122.22 0.85 Allowed Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.199 -0.524 . . . . 0.0 114.08 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 78.21 -25.81 0.19 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.643 0.777 . . . . 0.0 112.333 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -115.25 8.52 15.52 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.474 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.701 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 21.8 p -72.09 131.48 42.9 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.422 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -127.57 -17.73 4.53 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.299 179.202 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.53 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 91.0 m-85 -158.62 -84.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.91 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -33.26 107.12 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.27 -116.16 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.589 178.534 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.442 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -55.04 -103.22 0.01 OUTLIER Glycine 0 C--N 1.354 1.582 0 O-C-N 122.43 -0.169 . . . . 0.0 113.401 -178.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.763 HD12 ' H ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -100.45 -58.09 1.98 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.804 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.442 -0.962 0 CA-C-N 115.377 -0.829 . . . . 0.0 113.749 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.017 0.437 . . . . 0.0 111.628 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.55 41.12 3.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.125 -178.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.793 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.2 mt-10 -132.2 -168.36 2.03 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.793 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -164.21 142.05 7.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.148 0.499 . . . . 0.0 111.597 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.616 ' HA ' ' HD2' ' A' ' 34' ' ' HIS . 14.6 t -66.97 79.26 0.12 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.842 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.792 ' HG3' HD23 ' A' ' 14' ' ' LEU . 6.5 mtp85 -72.26 -97.96 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.626 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -74.59 -23.47 58.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.87 0.843 . . . . 0.0 109.958 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.6 m-85 -49.91 -48.58 51.6 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.456 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.56 -37.59 63.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.618 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.476 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.5 tt0 -58.43 -44.62 89.21 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 1.9 p 154.12 28.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.678 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.24 -95.15 0.08 OUTLIER Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.278 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.41 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -121.02 -54.01 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 122.05 0.929 . . . . 0.0 111.925 -178.586 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.74 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 64.05 78.96 0.27 Allowed 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.388 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.548 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -47.39 -21.51 0.32 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.443 -178.217 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.741 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 25.9 m-85 -133.45 47.68 2.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.538 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.11 120.76 0.94 Allowed Glycine 0 C--N 1.332 0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 114.109 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 81.51 -23.23 0.23 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.098 0.559 . . . . 0.0 112.221 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.51 19.51 9.61 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.245 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.648 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.7 p -84.43 127.48 34.04 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -176.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -123.16 -22.16 5.23 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.22 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.484 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 97.5 m-85 -160.54 -165.37 1.41 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.288 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.741 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 49.14 100.84 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.111 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.74 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -164.23 -109.81 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.092 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.423 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -75.66 -118.8 0.12 Allowed Glycine 0 C--N 1.349 1.252 0 CA-C-O 121.089 0.272 . . . . 0.0 113.024 -179.171 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -78.69 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.757 0.313 . . . . 0.0 111.202 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 C--N 1.333 0.389 0 CA-C-O 121.371 0.429 . . . . 0.0 113.972 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HD2' ' HB2' ' A' ' 33' ' ' ALA . 9.4 mttt . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 121.198 0.523 . . . . 0.0 112.143 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.6 t -129.01 37.32 4.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.932 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.66 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.2 mt-10 -118.67 -174.37 2.67 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.447 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.687 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -157.09 150.75 24.38 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.872 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.611 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -74.92 88.09 2.32 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.373 178.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.687 ' HG3' HD23 ' A' ' 14' ' ' LEU . 16.5 mtp180 -77.13 -99.88 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.2 t -73.06 -23.44 60.57 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.852 0.834 . . . . 0.0 110.061 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -49.54 -50.34 42.46 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.746 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 38.4 p -46.01 -15.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.268 -0.878 . . . . 0.0 113.353 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.1 OUTLIER -98.64 35.14 1.88 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.538 0.685 . . . . 0.0 110.961 -179.512 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 4.2 m 68.6 17.4 8.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.519 -1.218 . . . . 0.0 112.072 178.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.3 -88.25 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.25 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.44 -62.18 1.63 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.874 0.845 . . . . 0.0 111.563 -178.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.699 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.8 m 61.38 80.12 0.23 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.605 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -49.22 -21.47 0.8 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.037 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.684 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 19.6 m-85 -135.88 48.06 2.22 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.512 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.76 121.45 0.94 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 121.266 -0.492 . . . . 0.0 114.156 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.512 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 80.74 -25.55 0.17 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.239 0.615 . . . . 0.0 112.438 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -116.77 7.92 13.54 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.546 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.572 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.5 p -71.12 132.84 45.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.127 0.965 . . . . 0.0 113.557 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.74 -17.3 2.52 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 113.522 -1.672 . . . . 0.0 110.211 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.446 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 89.6 m-85 -157.98 -80.69 0.06 Allowed 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.684 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -40.41 109.72 0.12 Allowed 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.855 -177.429 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -169.51 -145.5 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.546 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -66.76 99.2 0.46 Allowed Glycine 0 C--N 1.345 1.06 0 O-C-N 122.042 -0.411 . . . . 0.0 112.3 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.747 HD23 ' N ' ' A' ' 37' ' ' GLY . 2.5 tt 54.9 169.13 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.298 0.57 . . . . 0.0 110.246 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.747 ' N ' HD23 ' A' ' 36' ' ' LEU . . . . . . . . 0 N--CA 1.431 -1.693 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.435 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.434 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.3 OUTLIER . . . . . 0 N--CA 1.449 -0.484 0 CA-C-O 121.281 0.563 . . . . 0.0 112.098 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 37' ' ' GLY . 5.6 t -128.12 36.69 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.679 -178.947 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.571 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -121.46 -170.09 1.97 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.15 -179.329 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.835 HD23 ' HD3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -164.25 143.91 7.75 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.022 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.639 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 17.7 t -64.87 84.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.835 ' HD3' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.83 -100.88 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.675 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' THR . . . . . 0.431 ' H ' ' HB3' ' A' ' 16' ' ' ARG . 6.1 t -69.69 -25.99 64.15 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.935 0.874 . . . . 0.0 109.913 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.1 m-85 -50.17 -53.04 30.5 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.309 -1.314 . . . . 0.0 111.238 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -46.67 -12.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.166 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.21 31.05 2.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.407 0.622 . . . . 0.0 110.667 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m 69.4 21.18 7.02 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.024 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.66 -92.75 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.059 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -64.18 1.2 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.917 0.865 . . . . 0.0 111.52 -179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.757 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.3 m 62.28 79.85 0.24 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.435 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.623 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 27.2 tpt180 -47.96 -20.31 0.32 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.12 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.766 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 17.8 m-85 -140.83 57.59 1.56 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.757 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -37.02 -35.08 0.12 Allowed Glycine 0 N--CA 1.465 0.601 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 -177.213 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.96 -16.66 13.06 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.321 1.06 . . . . 0.0 111.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 25.52 7.42 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.174 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.708 ' CA ' ' HB2' ' A' ' 26' ' ' TYR . 30.2 p -81.62 129.13 34.58 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.71 -15.4 2.09 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.589 -1.642 . . . . 0.0 110.253 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.538 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 81.2 m-85 -157.66 -82.33 0.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.766 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -37.75 102.98 0.03 OUTLIER 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.522 -177.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.706 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.93 -138.51 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.451 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.483 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -67.71 -163.95 2.4 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 118.312 0.505 . . . . 0.0 112.283 178.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.603 ' O ' HD21 ' A' ' 14' ' ' LEU . 7.8 tt -44.95 117.01 1.2 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.106 0.479 . . . . 0.0 110.321 179.036 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.432 ' O ' ' HG3' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.44 -1.036 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.424 ' HB2' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.365 0.602 . . . . 0.0 112.103 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' O ' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -112.07 -26.66 8.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.968 -1.014 . . . . 0.0 112.795 -178.359 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.788 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -79.49 -175.41 4.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.417 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.762 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -167.86 152.0 6.37 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.47 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.661 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.5 t -70.31 84.07 0.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.997 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.761 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.35 -100.2 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.839 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.1 t -72.38 -23.21 61.08 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.736 0.779 . . . . 0.0 110.432 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.59 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -52.52 -45.34 66.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.876 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -49.77 -11.08 0.05 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.734 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -96.73 33.73 1.8 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.583 0.706 . . . . 0.0 110.324 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.6 m 66.91 18.7 10.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.668 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.31 -92.72 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.856 -0.688 . . . . 0.0 113.157 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.425 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -109.89 -64.12 1.29 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.783 0.801 . . . . 0.0 112.179 -178.799 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.699 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 65.73 81.95 0.19 Allowed 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.561 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -51.07 -19.1 0.98 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.188 -178.42 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.642 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 23.5 m-85 -141.23 46.44 1.73 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.127 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.507 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.26 127.91 1.68 Allowed Glycine 0 C--N 1.334 0.47 0 CA-C-N 116.009 -0.542 . . . . 0.0 113.915 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.22 -23.88 0.24 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.01 0.433 . . . . 0.0 111.713 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.5 OUTLIER -124.01 19.72 9.18 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.885 -179.838 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.0 p -89.1 113.37 24.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -176.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.42 ' C ' ' CD1' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -110.46 -19.35 12.97 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.112 176.413 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.641 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 91.8 m-85 -160.69 -153.69 0.33 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.376 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.642 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 40.91 95.91 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.052 0.141 . . . . 0.0 111.092 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.66 -136.19 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -178.896 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.511 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -62.38 -104.05 0.01 OUTLIER Glycine 0 C--N 1.352 1.445 0 CA-C-N 118.672 0.669 . . . . 0.0 112.307 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -62.05 -130.21 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 178.876 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.788 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.437 -1.275 0 C-N-CA 120.299 -0.953 . . . . 0.0 114.726 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.529 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.711 0 CA-C-O 121.167 0.508 . . . . 0.0 111.044 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.1 t -117.79 -7.58 10.95 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.32 -178.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.82 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -79.72 -175.51 4.89 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.281 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.773 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -163.24 150.31 12.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.399 -178.771 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.604 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 8.6 t -71.96 81.66 0.93 Allowed 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.773 ' HG3' HD23 ' A' ' 14' ' ' LEU . 40.7 mtt-85 -75.69 -99.53 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.638 -179.087 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -74.75 -21.3 59.42 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.556 0.693 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.617 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -54.14 -45.48 71.98 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.653 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.73 -17.66 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.673 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.67 35.71 2.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.645 0.736 . . . . 0.0 110.175 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 m 69.0 12.39 8.6 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.415 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.568 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -63.01 -17.17 58.42 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.935 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 171.24 -68.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 4.0 m 64.3 83.83 0.16 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.358 -178.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.597 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 11.9 tpt180 -55.73 -13.75 1.88 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.931 -1.031 . . . . 0.0 112.104 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.615 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.3 m-85 -139.74 52.6 1.7 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.71 121.01 0.88 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 113.694 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 71.82 -17.12 0.36 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.97 0.508 . . . . 0.0 112.055 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -120.46 19.75 11.97 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.278 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.1 p -87.0 131.75 33.99 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.411 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.9 OUTLIER -128.1 -20.91 3.7 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.72 178.61 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.544 ' CD2' ' O ' ' A' ' 13' ' ' GLU . 78.9 m-85 -155.71 -87.93 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.615 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -28.88 102.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -160.39 -137.29 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.653 -179.711 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.558 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -46.11 -103.53 0.01 OUTLIER Glycine 0 C--N 1.344 1.013 0 O-C-N 121.861 -0.524 . . . . 0.0 113.621 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.41 ' O ' ' CG ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -89.03 -92.53 0.12 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.523 -0.338 . . . . 0.0 110.435 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.82 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 114.552 0.581 . . . . 0.0 114.552 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.464 0 CA-C-O 121.192 0.52 . . . . 0.0 111.852 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.9 t -125.09 41.35 3.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.745 -178.91 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.568 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -131.7 -168.0 1.96 Allowed 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.661 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -163.86 145.95 9.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.196 0.522 . . . . 0.0 111.787 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.631 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 24.6 t -71.55 81.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.243 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.661 ' HG3' HD23 ' A' ' 14' ' ' LEU . 9.7 mtp180 -75.44 -97.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -178.474 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -73.98 -20.86 60.21 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 121.706 0.765 . . . . 0.0 110.493 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.631 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.0 m-85 -52.93 -44.38 66.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.936 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 93.2 p -47.47 -18.21 0.12 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.381 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.16 33.01 2.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.583 0.706 . . . . 0.0 110.443 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.1 t 67.0 17.15 10.48 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.875 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.54 -25.95 69.24 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.887 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.08 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.747 0.784 . . . . 0.0 112.255 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.704 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 2.8 m 57.51 84.5 0.1 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.721 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.5 tpp180 -53.41 -17.02 1.64 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.849 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.62 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 23.0 m-85 -136.52 47.55 2.18 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.55 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.72 119.96 0.77 Allowed Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.898 -0.592 . . . . 0.0 114.115 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 82.5 -27.78 0.12 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.981 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -118.67 21.2 12.64 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.242 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.62 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 32.0 p -86.5 127.18 34.85 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -176.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.88 -20.62 5.35 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.968 -1.469 . . . . 0.0 109.676 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.441 ' HB3' ' HB2' ' A' ' 11' ' ' LYS . 97.1 m-85 -160.87 -160.89 0.78 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.899 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 45.07 95.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.633 178.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.704 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -159.44 -116.04 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.876 179.418 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.467 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -64.64 -119.8 0.01 OUTLIER Glycine 0 C--N 1.35 1.328 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.9 tp -69.45 -74.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.568 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.446 -0.644 0 CA-C-N 115.891 -0.595 . . . . 0.0 114.084 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 mttp . . . . . 0 N--CA 1.445 -0.695 0 CA-C-O 121.168 0.509 . . . . 0.0 112.051 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 t -127.78 44.46 2.93 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.465 -179.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.646 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.1 mt-10 -126.92 177.54 6.55 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.201 -178.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.788 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -154.03 153.58 32.18 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.599 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 16.2 t -75.41 83.48 2.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.376 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.788 ' HG3' HD23 ' A' ' 14' ' ' LEU . 17.5 mtp180 -77.04 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.708 0.29 . . . . 0.0 111.768 -178.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -70.8 -21.27 62.49 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.49 0.662 . . . . 0.0 110.337 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.614 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -54.22 -47.91 71.65 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.656 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.2 -15.12 0.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.192 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.23 31.05 1.77 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.532 0.682 . . . . 0.0 110.67 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 m 71.41 18.29 5.57 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.955 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.64 -91.15 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.929 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.455 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -115.42 -60.86 1.82 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.052 0.93 . . . . 0.0 112.198 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.714 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 64.9 83.89 0.16 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.104 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 10.8 tpt180 -53.95 -16.85 2.08 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.698 -178.096 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.617 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.0 m-85 -138.16 51.25 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.322 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.89 123.61 1.22 Allowed Glycine 0 CA--C 1.517 0.204 0 CA-C-N 115.91 -0.586 . . . . 0.0 113.492 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 74.16 -19.52 0.35 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.172 0.589 . . . . 0.0 112.405 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.68 16.49 10.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.16 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.617 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.0 p -80.54 131.45 35.54 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 122.169 0.985 . . . . 0.0 113.559 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.428 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -130.96 -16.96 3.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.252 179.347 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.428 ' CD1' ' O ' ' A' ' 31' ' ' GLN . 88.1 m-85 -158.06 -85.0 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.527 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.701 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -34.43 109.01 0.07 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.082 -177.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.714 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.52 -134.08 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 O-C-N 123.259 0.349 . . . . 0.0 110.388 -179.425 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.451 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -50.7 -111.05 0.01 OUTLIER Glycine 0 C--N 1.355 1.59 0 CA-C-N 118.58 0.627 . . . . 0.0 113.027 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.8 tp -75.38 -82.95 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.646 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.442 -0.901 0 C-N-CA 121.036 -0.602 . . . . 0.0 113.362 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.443 -0.79 0 CA-C-O 121.149 0.5 . . . . 0.0 111.515 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 t -119.87 13.99 12.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.583 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.605 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.9 mt-10 -96.53 -168.4 1.72 Allowed 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -178.297 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.631 HD22 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -168.99 153.54 5.67 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.441 0.639 . . . . 0.0 112.221 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.627 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.1 t -73.28 82.0 1.36 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.329 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.629 ' HG3' HD23 ' A' ' 14' ' ' LEU . 4.2 mtp85 -72.67 -98.47 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -178.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -75.4 -23.61 57.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.845 0.831 . . . . 0.0 110.086 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.594 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.1 -47.04 54.0 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.819 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.62 -11.31 0.05 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.834 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -97.6 33.03 2.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.585 0.707 . . . . 0.0 110.529 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.05 16.51 8.67 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.703 179.567 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -91.31 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.98 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.503 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -111.05 -63.96 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.957 0.884 . . . . 0.0 111.543 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.702 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.3 m 64.33 83.01 0.17 Allowed 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.98 -1.464 . . . . 0.0 109.382 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.503 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 2.2 tpt85 -50.92 -20.41 1.32 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.736 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.615 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 21.6 m-85 -142.39 55.92 1.44 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.702 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.85 -32.75 0.07 OUTLIER Glycine 0 N--CA 1.464 0.523 0 N-CA-C 115.677 1.031 . . . . 0.0 115.677 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.3 -17.04 13.25 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 118.337 1.068 . . . . 0.0 111.694 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.423 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.6 OUTLIER -126.08 25.9 6.63 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.226 -178.391 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.615 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 30.3 p -82.14 126.26 31.83 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.219 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -14.91 3.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.57 -1.65 . . . . 0.0 110.12 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.479 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 93.9 m-85 -158.83 -82.12 0.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.19 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.698 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -35.33 108.53 0.07 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.827 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -168.74 -136.74 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.05 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.448 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -50.52 -112.08 0.01 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.365 0.53 . . . . 0.0 113.469 179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -81.86 0.08 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.769 0.318 . . . . 0.0 110.271 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.605 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.445 -0.753 0 C-N-CA 121.307 -0.473 . . . . 0.0 113.677 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.419 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 121.184 0.516 . . . . 0.0 111.558 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.1 t -137.11 31.64 2.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.775 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.683 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -123.25 -170.49 2.12 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.686 -178.605 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.683 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -169.47 157.59 7.39 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.067 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.666 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.3 t -75.31 83.08 2.43 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.347 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.631 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -74.98 -99.58 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.476 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 t -75.71 -22.93 56.14 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.89 0.852 . . . . 0.0 109.991 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.642 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -51.67 -45.37 63.39 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.05 -1.432 . . . . 0.0 111.735 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.0 t -49.2 -16.9 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.292 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -100.91 34.39 2.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.601 0.715 . . . . 0.0 110.502 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 15.58 10.15 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.081 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.19 -17.36 70.01 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 121.128 -0.558 . . . . 0.0 114.082 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.581 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 173.73 -71.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.605 0.717 . . . . 0.0 112.541 -178.975 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.714 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.32 80.39 0.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.653 -178.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.469 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 5.7 tpp85 -53.47 -16.94 1.65 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.378 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.729 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.6 m-85 -142.55 47.61 1.57 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.078 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.424 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -36.82 128.49 1.09 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.122 -0.561 . . . . 0.0 113.494 -179.057 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 73.38 -25.22 0.19 Allowed 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 27' ' ' GLY . 9.1 ttpt -115.41 5.28 14.51 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.557 ' N ' ' O ' ' A' ' 26' ' ' TYR . 7.4 p -69.95 124.19 23.41 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -177.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.462 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -115.75 -22.34 9.19 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.398 -1.273 . . . . 0.0 109.408 178.895 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.469 ' HB3' ' H ' ' A' ' 13' ' ' GLU . 89.9 m-85 -159.97 -84.74 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.019 -179.254 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.729 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -27.03 104.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.398 0.679 . . . . 0.0 112.688 -178.457 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.714 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.56 -138.75 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.045 -179.704 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.555 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -44.15 -94.6 0.01 OUTLIER Glycine 0 C--N 1.346 1.131 0 CA-C-N 118.151 0.432 . . . . 0.0 113.636 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -104.13 -85.68 0.46 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.542 . . . . 0.0 110.901 -178.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.675 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.44 -1.073 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.041 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.169 0.509 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.2 t -130.86 44.24 2.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.326 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.651 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -121.98 -174.53 2.9 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.965 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.808 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -158.32 132.18 7.81 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.475 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.692 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 49.1 t -64.73 87.85 0.06 Allowed 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.808 ' HG3' HD23 ' A' ' 14' ' ' LEU . 32.5 mtp180 -83.91 -103.73 0.05 OUTLIER 'General case' 0 C--N 1.347 0.464 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.356 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -66.06 -23.54 66.55 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.932 0.872 . . . . 0.0 109.98 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.54 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.4 m-85 -51.81 -50.23 61.21 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.068 -1.424 . . . . 0.0 112.285 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.562 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 20.5 p -55.4 -35.43 65.32 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.772 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.7 tt0 -62.81 -41.23 99.21 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.976 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 13.2 p 152.94 13.52 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.203 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.12 -91.97 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.421 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.556 ' HE ' ' HD3' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -120.43 -63.08 1.39 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.971 0.891 . . . . 0.0 112.653 -178.046 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.739 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 70.64 79.67 0.17 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.154 -1.385 . . . . 0.0 108.698 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -54.4 -12.08 0.63 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.499 -178.635 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.597 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 12.3 m-85 -142.84 51.07 1.42 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.766 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.525 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.42 118.15 0.69 Allowed Glycine 0 CA--C 1.521 0.42 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.921 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 79.98 -23.17 0.25 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -118.27 13.69 13.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 14.3 p -77.73 130.77 37.17 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -176.757 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.03 -19.06 4.47 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.129 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.495 ' O ' ' HB2' ' A' ' 34' ' ' HIS . 94.1 m-85 -158.79 -85.64 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.448 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.597 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -28.42 101.18 0.02 OUTLIER 'General case' 0 C--N 1.35 0.604 0 O-C-N 123.239 0.337 . . . . 0.0 110.987 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.739 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -167.05 -156.72 0.22 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.147 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.46 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -44.96 110.64 0.43 Allowed Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 116.481 -0.327 . . . . 0.0 113.231 178.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 54.05 -92.13 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.541 -0.063 . . . . 0.0 111.075 179.107 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.636 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.445 -0.715 0 CA-C-O 121.482 0.49 . . . . 0.0 113.905 178.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.6 mttp . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.365 0.602 . . . . 0.0 111.588 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.6 t -122.98 3.98 9.36 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.956 -178.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.676 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 0.6 OUTLIER -87.46 179.26 6.6 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.455 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.542 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -159.87 164.98 33.12 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 121.271 0.558 . . . . 0.0 111.929 -179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.616 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 37.6 t -86.82 80.47 8.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.136 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.542 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -74.6 -101.84 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.878 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.7 t -66.9 -19.05 65.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.44 0.638 . . . . 0.0 110.052 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.687 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -60.3 -46.5 89.66 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.415 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -14.46 0.19 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.538 -179.191 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.17 32.97 2.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.482 0.658 . . . . 0.0 110.287 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.56 16.11 8.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.983 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.15 -91.03 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.704 -0.76 . . . . 0.0 113.095 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.63 -60.13 1.91 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.627 0.727 . . . . 0.0 111.928 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.741 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 63.64 77.76 0.31 Allowed 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.383 -1.28 . . . . 0.0 108.611 -178.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.422 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 3.5 tpt180 -49.81 -22.99 1.63 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.267 -178.064 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.591 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 21.1 m-85 -137.16 48.22 2.08 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.6 125.66 1.3 Allowed Glycine 0 CA--C 1.519 0.297 0 CA-C-N 115.896 -0.593 . . . . 0.0 114.197 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.06 -23.54 0.24 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 111.944 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -117.37 5.58 12.58 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.291 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 26' ' ' TYR . 16.8 p -71.48 125.08 26.11 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.658 0.742 . . . . 0.0 112.555 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.417 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -119.51 -18.49 8.45 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.829 179.566 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.437 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.9 m-85 -159.55 -79.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.978 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.637 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -37.88 110.91 0.14 Allowed 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.289 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.741 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.47 -121.1 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.069 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.471 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -56.09 -102.77 0.01 OUTLIER Glycine 0 C--N 1.356 1.661 0 O-C-N 122.011 -0.431 . . . . 0.0 113.255 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.518 HD12 ' H ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -94.15 -54.92 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.037 0.446 . . . . 0.0 110.275 179.863 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.676 ' CA ' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.445 -0.75 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.653 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 121.135 0.493 . . . . 0.0 111.941 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.2 t -119.36 -2.47 10.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.836 -178.73 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.749 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -80.35 -168.88 1.85 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.913 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.773 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -165.86 151.99 9.34 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.34 0.591 . . . . 0.0 112.339 -178.451 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.717 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 7.8 t -70.31 83.15 0.55 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.257 178.942 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.773 ' HG2' HD23 ' A' ' 14' ' ' LEU . 2.9 mmm-85 -77.29 -101.69 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 t -69.92 -23.32 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.771 0.796 . . . . 0.0 110.271 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.746 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -55.37 -44.57 76.18 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.685 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.9 t -46.59 -13.92 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.72 -179.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.58 30.95 1.63 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.493 0.663 . . . . 0.0 110.502 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.42 18.9 7.79 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.55 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.72 -90.65 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.932 -0.652 . . . . 0.0 113.639 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.423 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -113.12 -60.39 1.89 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.089 0.947 . . . . 0.0 112.219 -178.521 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.626 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.5 m 65.86 84.65 0.15 Allowed 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.854 -1.521 . . . . 0.0 108.116 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.644 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -50.39 -17.77 0.53 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.241 -178.04 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.714 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 20.1 m-85 -136.67 51.21 2.0 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.83 120.43 0.85 Allowed Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 114.299 -178.843 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.39 -17.59 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.0 0.52 . . . . 0.0 112.048 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.13 19.8 8.27 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.446 -179.369 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.714 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.3 p -81.57 122.61 27.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -177.536 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -115.44 -19.96 10.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.946 -1.479 . . . . 0.0 109.298 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.44 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 90.8 m-85 -156.99 -128.9 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.201 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.644 ' HB1' ' HG2' ' A' ' 25' ' ' ARG . . . 45.29 -157.49 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 121.138 0.494 . . . . 0.0 111.783 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.746 ' HA ' ' CE2' ' A' ' 18' ' ' TYR . 0.4 OUTLIER 78.71 -147.73 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.616 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.57 -161.26 0.51 Allowed Glycine 0 C--N 1.35 1.351 0 CA-C-O 121.237 0.354 . . . . 0.0 113.73 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.578 ' O ' HD21 ' A' ' 14' ' ' LEU . 5.8 tt -55.02 116.57 2.84 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.174 -0.513 . . . . 0.0 111.82 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.717 ' HA2' HD21 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.439 -1.151 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.336 177.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.44 -0.925 0 CA-C-O 121.272 0.558 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 t -127.38 19.72 6.83 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.103 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.792 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.2 mt-10 -100.99 -169.7 1.74 Allowed 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -178.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.764 HD11 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -164.06 156.11 16.84 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.718 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.788 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 26.5 t -76.39 87.58 3.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.237 178.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.685 ' HG2' ' CD2' ' A' ' 14' ' ' LEU . 2.1 mmm-85 -74.9 -104.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.3 t -74.65 -17.09 60.74 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 121.76 0.79 . . . . 0.0 110.587 -179.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.6 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.6 m-85 -56.16 -42.3 76.8 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.12 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -25.6 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.934 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.46 ' O ' ' CB ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -66.5 -44.08 83.59 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.445 179.456 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.46 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 33.8 p 153.09 19.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.072 179.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.99 -95.84 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.694 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.484 ' HD3' ' C ' ' A' ' 24' ' ' CYS . 0.0 OUTLIER -115.56 -58.27 2.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.909 0.862 . . . . 0.0 112.608 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.753 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.2 m 68.92 82.64 0.17 Allowed 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 113.736 -1.575 . . . . 0.0 107.535 -176.702 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.477 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 5.5 tpp85 -47.02 -21.0 0.17 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.418 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.648 ' HB2' ' CA ' ' A' ' 30' ' ' CYS . 21.0 m-85 -140.38 54.35 1.62 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.753 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.93 -30.23 0.04 OUTLIER Glycine 0 N--CA 1.467 0.744 0 N-CA-C 115.924 1.13 . . . . 0.0 115.924 -177.167 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -114.17 -12.7 12.47 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.988 0.894 . . . . 0.0 111.283 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.438 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -131.61 31.08 4.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.525 -178.574 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.648 ' CA ' ' HB2' ' A' ' 26' ' ' TYR . 30.8 p -86.01 108.68 18.34 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -15.16 13.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.022 -1.444 . . . . 0.0 108.335 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.433 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.3 m-85 -157.28 -133.21 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.205 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.613 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 45.8 -156.34 0.03 OUTLIER 'General case' 0 N--CA 1.458 -0.071 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.788 ' CD2' ' HA ' ' A' ' 15' ' ' CYS . 0.3 OUTLIER 76.9 -165.36 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.882 179.573 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 36' ' ' LEU . . . -59.11 108.24 1.53 Allowed Glycine 0 C--N 1.34 0.778 0 CA-C-N 115.84 -0.618 . . . . 0.0 113.507 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.887 HD23 ' N ' ' A' ' 37' ' ' GLY . 3.1 tt 51.41 161.09 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.756 0.789 . . . . 0.0 111.557 178.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.887 ' N ' HD23 ' A' ' 36' ' ' LEU . . . . . . . . 0 N--CA 1.433 -1.544 0 CA-C-N 115.124 -0.944 . . . . 0.0 113.019 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 18.9 mttt . . . . . 0 N--CA 1.446 -0.63 0 CA-C-O 121.6 0.714 . . . . 0.0 111.344 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.4 t -126.75 1.99 6.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.901 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.778 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -82.62 -169.11 2.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.529 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.75 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -162.2 155.23 20.21 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.811 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.738 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 36.0 t -77.72 85.27 4.03 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.75 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -71.48 -101.74 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.158 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 t -77.07 -23.12 51.97 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.001 0.905 . . . . 0.0 110.076 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.564 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -47.33 -51.39 19.53 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.277 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.78 -12.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.08 34.66 1.89 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.508 0.671 . . . . 0.0 110.347 179.398 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.32 16.65 9.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.359 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.2 -90.9 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.809 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.489 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -112.2 -65.33 1.19 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.585 0.707 . . . . 0.0 111.685 -179.102 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.742 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 64.82 81.8 0.2 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.024 -178.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.616 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 4.9 tpp85 -55.6 -13.61 1.69 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.049 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.725 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 15.5 m-30 -139.63 52.3 1.72 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.513 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.26 117.41 0.59 Allowed Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.114 -0.565 . . . . 0.0 114.333 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 78.95 -18.32 0.52 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -121.27 10.24 10.57 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.797 -179.16 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.562 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 16.5 p -74.66 130.94 40.43 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -177.058 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.468 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -132.21 -14.76 2.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.092 177.954 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.596 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 97.1 m-85 -158.89 -81.77 0.05 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.725 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -37.29 102.56 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 111.192 -177.543 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.742 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.48 -154.99 0.22 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.327 -179.062 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.551 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -62.69 97.63 0.19 Allowed Glycine 0 CA--C 1.496 -1.135 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 178.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 59.21 164.18 0.05 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.336 0.589 . . . . 0.0 110.129 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.778 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.43 -1.755 0 C-N-CA 120.17 -1.014 . . . . 0.0 113.187 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.436 ' O ' ' O ' ' A' ' 37' ' ' GLY . 3.4 t -132.92 24.85 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.365 -178.102 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.754 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -118.93 177.6 4.8 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -178.785 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.82 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -159.51 142.03 13.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.137 0.494 . . . . 0.0 112.205 -177.454 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.544 ' HA ' ' HD2' ' A' ' 34' ' ' HIS . 14.0 t -69.18 82.61 0.35 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.897 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.82 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -75.95 -99.62 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.704 0.288 . . . . 0.0 111.66 -178.96 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.4 t -72.97 -23.94 60.72 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.728 0.775 . . . . 0.0 109.974 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.557 ' CE1' ' CA ' ' A' ' 35' ' ' GLY . 3.0 m-85 -50.22 -47.15 55.01 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.923 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 p -49.12 -18.14 0.29 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.559 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.12 33.04 2.74 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.585 0.707 . . . . 0.0 110.62 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.99 17.28 8.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.292 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLY . . . . . 0.5 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.54 -19.8 73.18 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.725 -179.185 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 175.68 -69.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.716 0.769 . . . . 0.0 112.257 -179.259 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.735 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.7 m 64.26 81.48 0.21 Allowed 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.445 -1.252 . . . . 0.0 109.643 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.9 tpt180 -49.71 -19.46 0.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.112 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.568 ' O ' ' N ' ' A' ' 30' ' ' CYS . 24.2 m-85 -143.18 43.4 1.54 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.514 ' CA ' ' HB3' ' A' ' 24' ' ' CYS . . . -37.37 134.5 0.94 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.207 -0.52 . . . . 0.0 113.823 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 72.53 -24.67 0.19 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.996 0.427 . . . . 0.0 111.657 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.502 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -121.54 10.71 10.48 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.349 -179.001 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.568 ' N ' ' O ' ' A' ' 26' ' ' TYR . 25.6 p -79.8 118.67 21.8 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.473 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -110.34 -24.27 10.73 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.431 -1.258 . . . . 0.0 108.094 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.445 ' O ' ' O ' ' A' ' 33' ' ' ALA . 89.4 m-85 -161.14 -151.37 0.23 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.376 -1.284 . . . . 0.0 108.916 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 41.51 95.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 110.486 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.735 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.0 -143.22 0.06 Allowed 'General case' 0 CA--C 1.555 1.151 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.826 -177.88 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.557 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -63.94 118.95 14.38 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 122.171 -0.33 . . . . 0.0 113.248 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.638 HD23 ' N ' ' A' ' 37' ' ' GLY . 6.3 tt 46.55 -91.48 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.638 ' N ' HD23 ' A' ' 36' ' ' LEU . . . . . . . . 0 N--CA 1.447 -0.613 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.619 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mttp . . . . . 0 N--CA 1.454 -0.243 0 CA-C-O 121.246 0.546 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -134.11 36.4 3.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.637 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.588 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -127.52 -175.2 3.39 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 -178.825 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -169.04 148.4 4.07 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-O 121.189 0.518 . . . . 0.0 112.181 -179.24 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.607 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 15.2 t -69.42 78.22 0.39 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.507 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.428 ' HG3' HD23 ' A' ' 14' ' ' LEU . 8.8 mtt-85 -68.77 -95.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -178.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.8 t -77.91 -22.1 50.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.839 0.828 . . . . 0.0 110.257 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.713 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.4 m-85 -50.7 -43.49 57.78 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.494 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.4 p -56.3 -38.0 70.66 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.517 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -57.01 -47.56 80.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.223 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 0.3 OUTLIER 156.24 30.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.518 179.684 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.79 -96.49 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.954 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.413 ' HB3' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -120.12 -52.0 2.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.016 0.912 . . . . 0.0 111.755 -179.017 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.736 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 62.79 76.47 0.36 Allowed 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.835 -1.529 . . . . 0.0 108.281 -177.24 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 5.8 tpt180 -46.93 -21.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.375 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.555 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 27.7 m-85 -139.8 42.96 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.086 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.582 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.99 126.63 1.52 Allowed Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.937 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 86.03 -35.48 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.007 0.523 . . . . 0.0 111.874 -179.653 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 ttpt -114.81 9.27 16.25 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.052 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.555 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.2 p -72.5 116.12 12.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -176.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.415 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -109.24 -21.97 12.3 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.114 177.074 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.415 ' CG ' ' O ' ' A' ' 31' ' ' GLN . 86.2 m-85 -160.96 -157.49 0.52 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.553 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.606 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 41.94 102.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 178.658 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.736 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -165.28 -111.61 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.717 179.222 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.424 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -69.46 -119.71 0.03 OUTLIER Glycine 0 C--N 1.349 1.293 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.14 -73.6 0.16 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.943 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.588 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.444 -0.794 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.263 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HE3' ' HE2' ' A' ' 26' ' ' TYR . 9.3 mttm . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.267 0.556 . . . . 0.0 111.355 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.3 t -127.83 5.67 6.05 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.134 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.662 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 1.4 mt-10 -87.08 -176.47 5.72 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.137 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.637 HD13 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -160.9 149.4 16.26 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.379 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.625 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.2 t -72.49 86.32 1.16 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.71 178.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.598 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.11 -100.76 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -178.614 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 t -71.33 -23.19 61.89 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.702 0.763 . . . . 0.0 110.234 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.565 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.14 -50.12 49.78 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 114.595 -1.184 . . . . 0.0 112.181 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.47 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 88.8 p -56.01 -28.03 55.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.945 0.402 . . . . 0.0 112.058 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.543 ' O ' ' HB2' ' A' ' 21' ' ' SER . 2.2 tt0 -74.15 -39.81 63.03 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.91 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.543 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 35.0 t 159.36 10.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.536 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.48 -88.53 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.729 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.463 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -138.11 -57.81 0.66 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.144 0.973 . . . . 0.0 112.154 -178.123 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.738 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 74.22 77.37 0.12 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 113.217 -1.81 . . . . 0.0 108.381 -177.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 18.9 tpp180 -49.11 -16.92 0.17 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.725 -178.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.523 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 21.9 m-85 -142.95 48.96 1.48 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.61 126.66 1.79 Allowed Glycine 0 C--N 1.332 0.355 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.737 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.06 -18.44 0.44 Allowed 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 123.077 0.551 . . . . 0.0 112.202 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.79 17.88 6.79 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.57 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 23.7 p -85.01 115.61 22.93 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -177.114 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -112.09 -19.78 12.18 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.192 176.553 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.457 ' O ' ' O ' ' A' ' 33' ' ' ALA . 86.6 m-85 -160.75 -157.82 0.56 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.563 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.635 ' H ' ' HB2' ' A' ' 13' ' ' GLU . . . 42.34 98.25 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.143 0.177 . . . . 0.0 110.556 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.738 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.15 -142.23 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -178.241 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.515 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -56.87 -91.09 0.01 OUTLIER Glycine 0 C--N 1.35 1.329 0 N-CA-C 111.664 -0.575 . . . . 0.0 111.664 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.551 ' HB3' HD21 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -78.71 -152.53 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.409 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.662 ' CA ' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.439 -1.117 0 C-N-CA 119.615 -1.279 . . . . 0.0 114.12 179.251 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LYS . . . . . 0.483 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 120.724 0.297 . . . . 0.0 110.865 . . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 t -129.83 31.06 4.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.991 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.768 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.4 mt-10 -125.06 -167.52 1.69 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.218 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.768 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -166.25 155.88 11.79 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 112.061 -178.414 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.62 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.9 t -72.35 78.8 1.01 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.25 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.711 ' HG2' HD23 ' A' ' 14' ' ' LEU . 4.8 mmm180 -70.27 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.021 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.8 t -71.47 -20.65 62.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.668 0.746 . . . . 0.0 110.626 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.626 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -55.25 -47.05 75.98 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.798 -179.181 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -13.21 0.06 Allowed 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.282 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.41 31.49 1.97 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.625 0.726 . . . . 0.0 110.565 179.401 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.5 t 70.55 17.43 6.74 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.841 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -92.41 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.784 -0.722 . . . . 0.0 113.128 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HD3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -110.98 -61.78 1.64 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.982 0.896 . . . . 0.0 111.899 -178.999 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.74 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 63.71 81.39 0.21 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.046 -1.434 . . . . 0.0 108.684 -177.877 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.584 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -52.51 -19.87 2.55 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.285 -178.401 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.55 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.2 m-85 -137.36 49.55 2.0 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.149 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.504 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.82 119.98 0.8 Allowed Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.174 -0.467 . . . . 0.0 113.808 -179.188 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.14 -20.53 0.37 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 122.652 0.381 . . . . 0.0 111.627 -179.38 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.473 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -118.95 15.38 13.36 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.927 179.891 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.55 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 24.9 p -83.97 130.91 34.88 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.013 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -128.26 -18.38 4.09 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.056 -1.429 . . . . 0.0 110.201 178.763 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.493 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 95.3 m-85 -158.16 -74.48 0.09 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.644 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.685 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -41.43 105.12 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.796 -177.162 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.74 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.53 -133.33 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.732 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.431 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -68.64 -118.7 0.03 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.584 0.629 . . . . 0.0 111.736 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' LEU . . . . . 0.845 HD23 ' H ' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -70.89 -170.17 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.286 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.845 ' H ' HD23 ' A' ' 36' ' ' LEU . . . . . . . . 0 N--CA 1.441 -1.011 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.457 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.46 0.648 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.09 -22.32 11.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.469 -178.445 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.721 ' O ' ' HD2' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -79.4 -178.78 6.43 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.164 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.66 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -166.25 150.31 7.69 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.067 -178.582 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.625 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 9.2 t -67.74 77.48 0.2 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.66 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -67.02 -95.35 0.0 OUTLIER 'General case' 0 C--N 1.344 0.334 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 -178.896 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -80.39 -23.07 40.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 121.819 0.818 . . . . 0.0 110.054 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -48.42 -44.95 35.64 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.338 -1.301 . . . . 0.0 111.632 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.93 -11.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.71 32.77 1.37 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.536 0.684 . . . . 0.0 110.341 179.432 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m 65.45 28.65 11.56 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.664 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.06 -97.46 0.1 OUTLIER Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 116.048 -0.524 . . . . 0.0 113.062 -179.561 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.403 ' HB3' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -104.09 -58.59 1.86 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.719 0.771 . . . . 0.0 111.851 -179.155 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.708 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 58.04 81.04 0.16 Allowed 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.177 -177.825 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 6.6 tpm_? -51.64 -18.49 1.19 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.148 -178.738 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.687 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 25.9 m-85 -139.71 44.92 1.93 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.487 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.424 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.91 128.88 1.54 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.804 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.37 -24.49 0.22 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.051 -179.6 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 27' ' ' GLY . 5.1 ttpt -121.45 15.97 11.27 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.771 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.2 p -87.16 114.37 23.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -176.475 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.427 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -110.14 -19.12 13.15 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.769 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.721 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 86.5 m-85 -160.66 -160.99 0.8 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.896 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.687 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 46.58 98.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.73 178.754 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.708 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.21 -111.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.81 179.369 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.424 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -73.45 -127.37 0.12 Allowed Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 -179.62 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -74.68 0.07 Allowed 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.219 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.657 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.451 -0.341 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.842 178.845 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 CA-C-O 121.281 0.563 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -119.12 -8.86 10.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.635 -178.711 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.855 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -81.95 -174.87 5.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.177 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.855 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -167.98 154.86 7.93 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 121.043 0.449 . . . . 0.0 111.506 -178.825 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 15' ' ' CYS . . . . . 0.621 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.8 t -72.47 83.31 1.09 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.226 179.541 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.848 ' HG3' HD23 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.86 -101.09 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -178.345 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -70.89 -20.35 62.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.783 0.801 . . . . 0.0 109.862 179.603 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.708 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -55.53 -48.02 75.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.659 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.6 t -45.88 -27.85 0.97 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.242 -178.897 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.595 ' O ' ' CB ' ' A' ' 21' ' ' SER . 0.7 OUTLIER -76.3 -31.89 58.45 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.067 -179.802 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.595 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 10.7 t 138.31 2.43 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.998 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.78 -38.5 10.06 Favored Glycine 0 C--N 1.332 0.311 0 N-CA-C 114.726 0.651 . . . . 0.0 114.726 -178.899 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.47 -62.35 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.703 0.763 . . . . 0.0 112.611 -178.396 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.702 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 65.64 80.88 0.22 Allowed 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.133 -1.394 . . . . 0.0 109.096 -177.72 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 1.3 tpm_? -50.25 -21.23 1.28 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.733 -179.319 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' TYR . . . . . 0.601 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 24.9 m-85 -140.62 55.07 1.59 Allowed 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.285 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLY . . . . . 0.669 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.64 -35.39 0.12 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 115.61 1.004 . . . . 0.0 115.61 -177.224 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.69 -18.48 13.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 118.167 0.983 . . . . 0.0 112.085 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.22 28.52 6.02 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.952 -178.162 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' CYS . . . . . 0.593 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 31.8 p -87.24 116.85 25.6 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -177.549 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.488 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -120.42 -14.02 8.76 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.945 178.585 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.645 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.9 m-85 -158.33 -85.88 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -178.959 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.594 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -34.9 109.55 0.08 Allowed 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -177.84 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' HIS . . . . . 0.708 ' CG ' ' CD2' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -162.95 -112.06 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.287 178.415 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.479 ' HA2' ' CE1' ' A' ' 18' ' ' TYR . . . -58.41 -100.15 0.01 OUTLIER Glycine 0 C--N 1.348 1.226 0 N-CA-C 112.728 -0.149 . . . . 0.0 112.728 -179.237 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -116.3 -42.13 3.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.838 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.659 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.45 -0.4 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.847 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.782 0.325 . . . . 0.0 111.336 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.521 HG22 ' H ' ' A' ' 6' ' ' THR . 0.2 OUTLIER 57.38 -168.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.707 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.521 ' H ' HG22 ' A' ' 5' ' ' THR . 59.8 p -56.29 143.83 32.56 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.797 0.332 . . . . 0.0 110.964 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.21 46.54 0.91 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.791 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -177.18 -71.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.513 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.444 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 2.8 tpp85 61.7 151.47 0.03 OUTLIER 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.254 0.55 . . . . 0.0 111.076 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.474 ' CB ' ' CE1' ' A' ' 32' ' ' PHE . 3.9 m-85 -63.95 -162.84 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.058 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -67.97 -166.2 0.06 Allowed 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 121.302 0.572 . . . . 0.0 111.266 -178.466 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.632 ' O ' HD12 ' A' ' 39' ' ' LEU . 3.0 t -119.87 1.0 10.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.191 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.564 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -81.57 -173.74 4.57 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.384 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.806 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -161.12 147.92 14.94 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.857 -179.362 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.638 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 18.8 t -72.34 85.9 1.11 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.806 ' HG3' HD23 ' A' ' 14' ' ' LEU . 1.1 mtp85 -78.07 -101.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -71.66 -21.48 61.81 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.737 0.78 . . . . 0.0 110.047 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.592 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -52.99 -48.07 67.76 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.493 -1.231 . . . . 0.0 112.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.12 -12.8 0.09 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.843 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.39 32.96 2.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.473 0.654 . . . . 0.0 110.6 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 70.02 15.11 7.78 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.689 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.0 -88.62 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.954 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -114.93 -64.45 1.31 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.843 0.83 . . . . 0.0 112.153 -178.725 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.17 83.97 0.16 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.711 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.589 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 16.2 tpt85 -55.36 -14.1 1.72 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.439 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.699 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.7 m-85 -139.2 51.91 1.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.49 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.4 118.81 0.76 Allowed Glycine 0 CA--C 1.52 0.401 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.943 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.7 -14.97 0.73 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.736 0.414 . . . . 0.0 111.967 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.474 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -124.94 17.09 8.57 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.273 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.651 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 27.3 p -84.3 132.59 34.6 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.143 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.418 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -131.17 -17.36 3.05 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.65 -1.613 . . . . 0.0 110.38 178.827 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.487 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 82.8 m-85 -157.75 -85.79 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.699 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -33.26 105.57 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -177.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -161.99 -139.67 0.05 Allowed 'General case' 0 CA--C 1.557 1.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 -179.325 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -50.68 -113.53 0.01 OUTLIER Glycine 0 C--N 1.348 1.218 0 CA-C-N 118.118 0.417 . . . . 0.0 114.015 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.401 HD23 ' HG3' ' A' ' 38' ' ' GLU . 0.3 OUTLIER -63.14 -75.19 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.96 0.409 . . . . 0.0 111.436 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.564 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 49.77 79.75 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.864 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.401 ' HG3' HD23 ' A' ' 36' ' ' LEU . 4.7 mt-10 -134.37 39.39 3.07 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.122 0.486 . . . . 0.0 109.69 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.632 HD12 ' O ' ' A' ' 12' ' ' THR . 11.1 mt -54.35 -46.38 72.93 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.582 -178.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.629 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -101.01 37.52 1.73 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.759 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 24.2 mm-40 -152.03 12.86 0.59 Allowed 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.551 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 41' ' ' GLN . . . 178.74 -22.45 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.33 -0.395 . . . . 0.0 112.007 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.519 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.122 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.941 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.4 ttp . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.956 0.408 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 46.3 p -135.58 -52.11 0.75 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.522 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.508 ' OG1' ' HB2' ' A' ' 9' ' ' ARG . 10.2 t -66.87 167.59 11.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.283 -179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.28 -40.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.918 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.0 m -86.21 -16.66 37.04 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.556 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.508 ' HB2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -68.11 -175.43 0.59 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.677 0.275 . . . . 0.0 110.489 179.48 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.67 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 5.1 m-85 -76.99 -165.33 0.54 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.895 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.465 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -71.21 -167.53 0.23 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.956 0.407 . . . . 0.0 110.965 -179.015 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.652 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 2.9 t -127.84 2.61 6.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.208 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.664 ' CG ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -86.67 -174.03 4.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.454 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.795 HD12 HD11 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -169.01 156.51 7.32 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.554 0.692 . . . . 0.0 112.571 -179.201 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.658 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 5.1 t -71.17 84.02 0.73 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.692 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.523 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -70.04 -97.71 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.822 0.344 . . . . 0.0 111.504 -179.109 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -81.59 -19.82 41.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 122.055 0.931 . . . . 0.0 110.171 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.715 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -50.61 -51.12 51.61 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.388 -1.278 . . . . 0.0 112.567 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.11 -32.29 22.16 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.897 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.458 ' O ' ' CB ' ' A' ' 21' ' ' SER . 3.7 tt0 -68.16 -40.89 82.21 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.113 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 0.4 OUTLIER 158.64 18.63 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.93 -90.76 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 121.386 -0.435 . . . . 0.0 113.735 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 1.3 ttt180 -133.36 -57.15 0.9 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.123 0.963 . . . . 0.0 112.272 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.72 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 72.46 79.85 0.15 Allowed 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.369 -1.741 . . . . 0.0 108.531 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.464 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 12.0 tpt180 -50.96 -16.91 0.49 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.441 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.522 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 18.1 m-85 -140.91 49.9 1.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.83 126.02 1.42 Allowed Glycine 0 C--N 1.335 0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.212 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 70.96 -14.35 0.45 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.14 -0.53 . . . . 0.0 112.219 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -127.85 17.58 6.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 122.688 0.395 . . . . 0.0 111.299 -179.542 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' TYR . 26.6 p -87.37 107.28 18.46 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.507 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -103.67 -16.86 15.35 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.046 176.283 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.67 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 97.6 m-85 -153.71 -138.79 0.08 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.793 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.665 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 51.75 -158.94 0.11 Allowed 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.334 -0.229 . . . . 0.0 111.093 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.72 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER 83.59 -147.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 178.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -61.39 -132.42 0.01 OUTLIER Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.262 0.465 . . . . 0.0 114.262 -178.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.904 HD23 ' H ' ' A' ' 38' ' ' GLU . 1.0 OUTLIER -37.22 -77.12 0.02 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.656 -0.772 . . . . 0.0 111.502 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.664 ' HA3' ' CG ' ' A' ' 13' ' ' GLU . . . 52.23 20.82 7.33 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.275 -0.488 . . . . 0.0 113.937 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.904 ' H ' HD23 ' A' ' 36' ' ' LEU . 2.5 mt-10 -85.51 46.3 1.29 Allowed 'General case' 0 C--N 1.312 -1.048 0 O-C-N 122.588 -0.36 . . . . 0.0 111.364 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.795 HD11 HD12 ' A' ' 14' ' ' LEU . 20.7 mt -54.1 -56.02 22.09 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.584 0.706 . . . . 0.0 110.934 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.652 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -93.15 39.87 1.05 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.5 -1.227 . . . . 0.0 111.031 -179.483 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.601 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 16.7 mt-30 -153.73 -58.14 0.12 Allowed 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.07 0.462 . . . . 0.0 110.362 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 56.69 -177.81 0.05 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.24 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.165 -0.922 . . . . 0.0 110.993 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.9 mtt . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.747 0.308 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.9 t -84.63 138.3 32.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.857 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -108.93 -31.34 7.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.159 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.0 p 65.72 34.99 7.16 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.999 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.5 m 60.14 71.37 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.869 0.366 . . . . 0.0 110.84 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 153.72 30.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.976 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.571 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.7 m-85 -73.72 -164.25 0.21 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.411 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -69.67 -166.7 0.11 Allowed 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.06 0.457 . . . . 0.0 110.765 -179.126 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.63 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 6.1 t -121.67 -3.92 9.25 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.447 -179.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.804 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -79.91 -170.45 2.44 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.93 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.665 HD12 HD11 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -166.06 144.84 5.88 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.337 0.589 . . . . 0.0 111.899 -179.089 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.64 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -71.16 84.73 0.74 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.537 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.688 ' CD ' HD11 ' A' ' 36' ' ' LEU . 3.8 mtp180 -79.48 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -71.34 -18.91 62.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.548 0.689 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.692 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.8 m-85 -53.55 -48.08 69.44 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.943 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.52 -36.77 7.07 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.18 0.514 . . . . 0.0 111.747 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.526 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.6 tt0 -67.73 -38.17 83.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 14.4 t 150.53 -0.72 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.718 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -43.25 -41.11 4.85 Favored Glycine 0 C--N 1.332 0.342 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -178.26 -60.27 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.463 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 67.26 80.78 0.21 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.661 -176.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.613 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 3.9 tpp180 -52.52 -18.72 1.84 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.674 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.91 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 23.6 m-85 -137.09 49.76 2.02 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.09 122.22 0.85 Allowed Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.199 -0.524 . . . . 0.0 114.08 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 78.21 -25.81 0.19 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.643 0.777 . . . . 0.0 112.333 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -115.25 8.52 15.52 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.474 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.701 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 21.8 p -72.09 131.48 42.9 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.422 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -127.57 -17.73 4.53 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.299 179.202 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.571 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 91.0 m-85 -158.62 -84.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.91 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -33.26 107.12 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.27 -116.16 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.589 178.534 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.442 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -55.04 -103.22 0.01 OUTLIER Glycine 0 C--N 1.354 1.582 0 O-C-N 122.43 -0.169 . . . . 0.0 113.401 -178.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.763 HD12 ' H ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -100.45 -58.09 1.98 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.804 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 50.32 86.02 0.02 OUTLIER Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.377 -0.829 . . . . 0.0 113.749 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -128.2 46.85 2.51 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.126 -0.537 . . . . 0.0 110.552 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.665 HD11 HD12 ' A' ' 14' ' ' LEU . 11.3 mt -59.84 -30.22 68.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.667 -179.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.63 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -127.13 35.19 4.61 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.503 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.599 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 1.9 mm-40 -151.09 72.48 1.06 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.618 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -51.05 178.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.344 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.746 179.939 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.6 ttm . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.747 0.308 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.66 -78.96 0.16 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.89 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.84 148.98 36.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.862 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.8 m -111.2 -37.38 5.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.023 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.58 93.31 0.92 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.813 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.14 -173.08 4.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.163 0.506 . . . . 0.0 111.019 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 3.6 m-85 -78.22 -161.82 0.3 Allowed 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.125 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -62.68 -161.78 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.628 -178.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.55 41.12 3.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.125 -178.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.793 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.2 mt-10 -132.2 -168.36 2.03 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.793 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -164.21 142.05 7.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.148 0.499 . . . . 0.0 111.597 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.616 ' HA ' ' HD2' ' A' ' 34' ' ' HIS . 14.6 t -66.97 79.26 0.12 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.842 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.792 ' HG3' HD23 ' A' ' 14' ' ' LEU . 6.5 mtp85 -72.26 -97.96 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.626 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -74.59 -23.47 58.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.87 0.843 . . . . 0.0 109.958 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.6 m-85 -49.91 -48.58 51.6 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.456 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.56 -37.59 63.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.618 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.476 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.5 tt0 -58.43 -44.62 89.21 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 1.9 p 154.12 28.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.678 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.24 -95.15 0.08 OUTLIER Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.278 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.41 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -121.02 -54.01 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 122.05 0.929 . . . . 0.0 111.925 -178.586 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.74 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 64.05 78.96 0.27 Allowed 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.388 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.548 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -47.39 -21.51 0.32 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.443 -178.217 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.741 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 25.9 m-85 -133.45 47.68 2.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.538 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.11 120.76 0.94 Allowed Glycine 0 C--N 1.332 0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 114.109 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 81.51 -23.23 0.23 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.098 0.559 . . . . 0.0 112.221 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.51 19.51 9.61 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.245 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.648 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.7 p -84.43 127.48 34.04 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -176.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -123.16 -22.16 5.23 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.22 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.507 ' CD1' ' HB3' ' A' ' 10' ' ' TYR . 97.5 m-85 -160.54 -165.37 1.41 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.288 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.741 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 49.14 100.84 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.111 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.74 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -164.23 -109.81 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.092 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.423 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -75.66 -118.8 0.12 Allowed Glycine 0 C--N 1.349 1.252 0 CA-C-O 121.089 0.272 . . . . 0.0 113.024 -179.171 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -78.69 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.757 0.313 . . . . 0.0 111.202 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 44.28 80.07 0.05 OUTLIER Glycine 0 C--N 1.333 0.389 0 CA-C-O 121.371 0.429 . . . . 0.0 113.972 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -135.73 41.2 2.73 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.064 -0.568 . . . . 0.0 109.992 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.408 HD12 HD12 ' A' ' 14' ' ' LEU . 10.3 mt -82.95 -23.51 33.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.788 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -121.58 55.02 1.11 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.136 179.476 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 27.2 mt-30 -158.74 10.71 0.15 Allowed 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.404 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 41' ' ' GLN . . . 178.22 -62.63 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 120.84 0.352 . . . . 0.0 111.289 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.5 m120 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.015 -179.777 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.0 ttt . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 120.725 0.298 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.7 p 67.34 18.13 10.2 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.362 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.4 p -105.1 123.85 48.53 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.575 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.2 t -112.01 -63.72 1.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.849 0.357 . . . . 0.0 110.86 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.98 -73.56 0.68 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.056 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.39 -167.62 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.021 0.439 . . . . 0.0 110.601 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.477 ' HB3' ' CD2' ' A' ' 32' ' ' PHE . 4.1 m-85 -86.24 -163.03 0.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.88 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HD2' ' HB2' ' A' ' 33' ' ' ALA . 9.4 mttt -72.47 -164.96 0.17 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.198 0.523 . . . . 0.0 112.143 -178.369 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.453 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 2.6 t -129.01 37.32 4.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.932 -178.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.66 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.2 mt-10 -118.67 -174.37 2.67 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.447 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.87 HD12 HD11 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -157.09 150.75 24.38 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.872 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.611 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -74.92 88.09 2.32 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.373 178.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.687 ' HG3' HD23 ' A' ' 14' ' ' LEU . 16.5 mtp180 -77.13 -99.88 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.2 t -73.06 -23.44 60.57 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.852 0.834 . . . . 0.0 110.061 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -49.54 -50.34 42.46 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.746 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 38.4 p -46.01 -15.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.268 -0.878 . . . . 0.0 113.353 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.1 OUTLIER -98.64 35.14 1.88 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.538 0.685 . . . . 0.0 110.961 -179.512 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 4.2 m 68.6 17.4 8.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.519 -1.218 . . . . 0.0 112.072 178.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.3 -88.25 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.25 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.44 -62.18 1.63 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.874 0.845 . . . . 0.0 111.563 -178.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.699 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.8 m 61.38 80.12 0.23 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.605 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -49.22 -21.47 0.8 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.037 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.684 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 19.6 m-85 -135.88 48.06 2.22 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.512 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.76 121.45 0.94 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 121.266 -0.492 . . . . 0.0 114.156 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.512 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 80.74 -25.55 0.17 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.239 0.615 . . . . 0.0 112.438 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -116.77 7.92 13.54 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.546 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.572 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.5 p -71.12 132.84 45.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.127 0.965 . . . . 0.0 113.557 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.74 -17.3 2.52 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 113.522 -1.672 . . . . 0.0 110.211 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.477 ' CD2' ' HB3' ' A' ' 10' ' ' TYR . 89.6 m-85 -157.98 -80.69 0.06 Allowed 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.684 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -40.41 109.72 0.12 Allowed 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.855 -177.429 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -169.51 -145.5 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.546 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -66.76 99.2 0.46 Allowed Glycine 0 C--N 1.345 1.06 0 O-C-N 122.042 -0.411 . . . . 0.0 112.3 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.747 HD23 ' N ' ' A' ' 37' ' ' GLY . 2.5 tt 54.9 169.13 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.298 0.57 . . . . 0.0 110.246 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.747 ' N ' HD23 ' A' ' 36' ' ' LEU . . . -177.76 -101.08 0.14 Allowed Glycine 0 N--CA 1.431 -1.693 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.435 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' A' ' 41' ' ' GLN . 35.5 mt-10 50.74 23.32 1.35 Allowed 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.87 HD11 HD12 ' A' ' 14' ' ' LEU . 6.2 mt -38.88 -43.58 0.96 Allowed 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.438 0.637 . . . . 0.0 111.035 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.453 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -99.05 35.56 1.87 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.537 179.554 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' A' ' 38' ' ' GLU . 30.3 mt-30 -162.72 57.76 0.21 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.922 0.391 . . . . 0.0 110.79 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -46.21 141.57 3.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.91 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.354 -0.832 . . . . 0.0 110.845 179.755 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 120.874 0.369 . . . . 0.0 111.364 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.57 50.16 0.61 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.402 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.641 HG21 ' NH1' ' A' ' 9' ' ' ARG . 6.2 p 51.4 102.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.382 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.7 p -58.68 137.81 57.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.269 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 70.26 -64.4 0.36 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.101 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.641 ' NH1' HG21 ' A' ' 6' ' ' THR . 0.0 OUTLIER -44.39 161.24 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.41 -179.783 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.509 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 4.1 m-85 -80.33 -163.35 0.55 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.971 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.434 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -70.84 -163.62 0.08 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.281 0.563 . . . . 0.0 112.098 -178.247 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.591 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 5.6 t -128.12 36.69 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.679 -178.947 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -121.46 -170.09 1.97 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.15 -179.329 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.835 HD23 ' HD3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -164.25 143.91 7.75 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.022 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.639 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 17.7 t -64.87 84.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.835 ' HD3' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.83 -100.88 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.675 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.431 ' H ' ' HB3' ' A' ' 16' ' ' ARG . 6.1 t -69.69 -25.99 64.15 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.935 0.874 . . . . 0.0 109.913 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.1 m-85 -50.17 -53.04 30.5 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.309 -1.314 . . . . 0.0 111.238 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -46.67 -12.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.166 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.21 31.05 2.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.407 0.622 . . . . 0.0 110.667 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m 69.4 21.18 7.02 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.024 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.66 -92.75 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.059 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -64.18 1.2 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.917 0.865 . . . . 0.0 111.52 -179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.757 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.3 m 62.28 79.85 0.24 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.435 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.623 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 27.2 tpt180 -47.96 -20.31 0.32 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.12 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.766 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 17.8 m-85 -140.83 57.59 1.56 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.757 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -37.02 -35.08 0.12 Allowed Glycine 0 N--CA 1.465 0.601 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 -177.213 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.96 -16.66 13.06 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.321 1.06 . . . . 0.0 111.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 25.52 7.42 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.174 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.708 ' CA ' ' HB2' ' A' ' 26' ' ' TYR . 30.2 p -81.62 129.13 34.58 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.71 -15.4 2.09 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.589 -1.642 . . . . 0.0 110.253 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.538 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 81.2 m-85 -157.66 -82.33 0.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.766 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -37.75 102.98 0.03 OUTLIER 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.522 -177.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.706 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.93 -138.51 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.451 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.483 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -67.71 -163.95 2.4 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 118.312 0.505 . . . . 0.0 112.283 178.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.603 ' O ' HD21 ' A' ' 14' ' ' LEU . 7.8 tt -44.95 117.01 1.2 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.106 0.479 . . . . 0.0 110.321 179.036 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.432 ' O ' ' HG3' ' A' ' 13' ' ' GLU . . . -159.89 90.56 0.11 Allowed Glycine 0 N--CA 1.44 -1.036 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.689 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 2.0 mm-40 -110.12 39.36 2.18 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.099 -0.55 . . . . 0.0 111.564 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.422 HD11 HD12 ' A' ' 14' ' ' LEU . 5.3 mt -39.79 -41.14 1.07 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.168 0.508 . . . . 0.0 111.936 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.591 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -112.48 39.23 2.52 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.151 179.32 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.689 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 77.5 mt-30 -155.13 -16.99 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.775 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.87 113.81 2.48 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 120.908 0.385 . . . . 0.0 111.162 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.807 -179.976 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 120.77 0.319 . . . . 0.0 111.34 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.33 83.63 2.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.78 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.2 p -96.52 109.72 22.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.936 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -81.17 105.54 12.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.722 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m 73.92 -65.44 0.35 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.634 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.0 tpp180 62.97 159.18 0.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.664 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.565 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 5.3 m-85 -68.82 -163.31 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.908 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.424 ' HB2' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -60.47 -166.81 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.365 0.602 . . . . 0.0 112.103 -178.304 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.842 HG22 ' HB2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -112.07 -26.66 8.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.968 -1.014 . . . . 0.0 112.795 -178.359 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.788 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -79.49 -175.41 4.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.417 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.762 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -167.86 152.0 6.37 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.47 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.661 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.5 t -70.31 84.07 0.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.997 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.761 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.35 -100.2 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.839 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.1 t -72.38 -23.21 61.08 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.736 0.779 . . . . 0.0 110.432 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.59 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -52.52 -45.34 66.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.876 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -49.77 -11.08 0.05 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.734 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -96.73 33.73 1.8 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.583 0.706 . . . . 0.0 110.324 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.6 m 66.91 18.7 10.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.668 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.31 -92.72 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.856 -0.688 . . . . 0.0 113.157 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.425 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -109.89 -64.12 1.29 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.783 0.801 . . . . 0.0 112.179 -178.799 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.699 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 65.73 81.95 0.19 Allowed 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.561 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -51.07 -19.1 0.98 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.188 -178.42 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.642 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 23.5 m-85 -141.23 46.44 1.73 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.127 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.507 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.26 127.91 1.68 Allowed Glycine 0 C--N 1.334 0.47 0 CA-C-N 116.009 -0.542 . . . . 0.0 113.915 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.22 -23.88 0.24 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.01 0.433 . . . . 0.0 111.713 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.5 OUTLIER -124.01 19.72 9.18 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.885 -179.838 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.0 p -89.1 113.37 24.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -176.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.42 ' C ' ' CD1' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -110.46 -19.35 12.97 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.112 176.413 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.641 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 91.8 m-85 -160.69 -153.69 0.33 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.376 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.642 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 40.91 95.91 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.052 0.141 . . . . 0.0 111.092 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.66 -136.19 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -178.896 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.511 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -62.38 -104.05 0.01 OUTLIER Glycine 0 C--N 1.352 1.445 0 CA-C-N 118.672 0.669 . . . . 0.0 112.307 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -62.05 -130.21 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 178.876 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.788 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 100.09 -1.67 56.4 Favored Glycine 0 N--CA 1.437 -1.275 0 C-N-CA 120.299 -0.953 . . . . 0.0 114.726 177.625 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -87.51 32.55 0.71 Allowed 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.697 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.748 HD12 HD11 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -82.11 -20.16 38.65 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.925 0.393 . . . . 0.0 111.258 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.842 ' HB2' HG22 ' A' ' 12' ' ' THR . 0.0 OUTLIER -111.4 31.12 6.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.164 179.427 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.75 ' CG ' HG21 ' A' ' 12' ' ' THR . 2.9 mm-40 -151.2 -54.76 0.14 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.005 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 60.22 114.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.181 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.82 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.492 ' O ' ' HB ' ' A' ' 5' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 120.652 0.263 . . . . 0.0 111.09 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.492 ' HB ' ' O ' ' A' ' 4' ' ' MET . 21.0 m 84.13 -39.96 0.07 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.023 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.6 p -145.15 -76.1 0.22 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.298 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 m 60.57 82.68 0.16 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.089 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m 55.72 33.21 20.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.662 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.443 ' HD2' HH12 ' A' ' 40' ' ' ARG . 0.0 OUTLIER -75.35 168.17 20.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.156 0.503 . . . . 0.0 110.647 -179.976 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.524 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.4 m-85 -75.35 -161.23 0.14 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.679 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.529 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -67.24 -164.81 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.167 0.508 . . . . 0.0 111.044 -178.478 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.936 HG21 ' HG3' ' A' ' 41' ' ' GLN . 1.1 t -117.79 -7.58 10.95 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.32 -178.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.82 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -79.72 -175.51 4.89 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.281 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.773 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -163.24 150.31 12.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.399 -178.771 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.604 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 8.6 t -71.96 81.66 0.93 Allowed 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.773 ' HG3' HD23 ' A' ' 14' ' ' LEU . 40.7 mtt-85 -75.69 -99.53 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.638 -179.087 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -74.75 -21.3 59.42 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.556 0.693 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.617 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -54.14 -45.48 71.98 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.653 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.73 -17.66 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.673 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.67 35.71 2.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.645 0.736 . . . . 0.0 110.175 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 m 69.0 12.39 8.6 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.415 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.568 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -63.01 -17.17 58.42 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.935 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 171.24 -68.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 4.0 m 64.3 83.83 0.16 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.358 -178.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.597 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 11.9 tpt180 -55.73 -13.75 1.88 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.931 -1.031 . . . . 0.0 112.104 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.615 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.3 m-85 -139.74 52.6 1.7 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.71 121.01 0.88 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 113.694 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 71.82 -17.12 0.36 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.97 0.508 . . . . 0.0 112.055 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -120.46 19.75 11.97 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.278 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.1 p -87.0 131.75 33.99 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.411 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.9 OUTLIER -128.1 -20.91 3.7 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.72 178.61 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.544 ' CD2' ' O ' ' A' ' 13' ' ' GLU . 78.9 m-85 -155.71 -87.93 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.615 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -28.88 102.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -160.39 -137.29 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.653 -179.711 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.558 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -46.11 -103.53 0.01 OUTLIER Glycine 0 C--N 1.344 1.013 0 O-C-N 121.861 -0.524 . . . . 0.0 113.621 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.41 ' O ' ' CG ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -89.03 -92.53 0.12 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.523 -0.338 . . . . 0.0 110.435 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.82 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 57.05 68.97 1.42 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 114.552 0.581 . . . . 0.0 114.552 178.048 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -128.24 31.62 5.02 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -77.12 -8.4 57.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.246 -178.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.468 ' HG3' ' HA ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -124.2 18.42 9.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.189 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.936 ' HG3' HG21 ' A' ' 12' ' ' THR . 14.1 mm-40 -146.22 -26.49 0.43 Allowed 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.9 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -45.59 128.46 8.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.098 0.475 . . . . 0.0 111.723 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.357 -0.83 . . . . 0.0 110.707 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 40.1 mtt . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 120.803 0.335 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 t -76.12 115.95 16.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.0 110.01 22.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.993 0.425 . . . . 0.0 110.973 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.22 132.88 47.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.665 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.4 m 62.42 31.05 17.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.17 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.98 169.62 16.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.875 0.369 . . . . 0.0 110.15 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.65 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 4.0 m-85 -79.33 -159.76 0.21 Allowed 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.924 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -73.91 -164.56 0.23 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.192 0.52 . . . . 0.0 111.852 -177.132 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.602 ' OG1' ' HG3' ' A' ' 40' ' ' ARG . 3.9 t -125.09 41.35 3.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.745 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.568 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -131.7 -168.0 1.96 Allowed 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.661 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -163.86 145.95 9.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.196 0.522 . . . . 0.0 111.787 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.631 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 24.6 t -71.55 81.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.243 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.661 ' HG3' HD23 ' A' ' 14' ' ' LEU . 9.7 mtp180 -75.44 -97.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -178.474 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -73.98 -20.86 60.21 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 121.706 0.765 . . . . 0.0 110.493 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.631 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.0 m-85 -52.93 -44.38 66.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.936 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 93.2 p -47.47 -18.21 0.12 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.381 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.16 33.01 2.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.583 0.706 . . . . 0.0 110.443 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.1 t 67.0 17.15 10.48 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.875 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.54 -25.95 69.24 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.887 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.08 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.747 0.784 . . . . 0.0 112.255 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.704 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 2.8 m 57.51 84.5 0.1 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.721 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.5 tpp180 -53.41 -17.02 1.64 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.849 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.62 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 23.0 m-85 -136.52 47.55 2.18 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.55 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.72 119.96 0.77 Allowed Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.898 -0.592 . . . . 0.0 114.115 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 82.5 -27.78 0.12 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.981 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -118.67 21.2 12.64 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.242 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.62 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 32.0 p -86.5 127.18 34.85 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -176.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.88 -20.62 5.35 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.968 -1.469 . . . . 0.0 109.676 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.65 ' CD1' ' HB3' ' A' ' 10' ' ' TYR . 97.1 m-85 -160.87 -160.89 0.78 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.899 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 45.07 95.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.633 178.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.704 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -159.44 -116.04 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.876 179.418 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.467 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -64.64 -119.8 0.01 OUTLIER Glycine 0 C--N 1.35 1.328 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.496 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 6.9 tp -69.45 -74.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.105 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.568 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 55.01 84.32 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.891 -0.595 . . . . 0.0 114.084 178.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.496 ' HG3' ' HG ' ' A' ' 36' ' ' LEU . 4.3 mt-10 -139.85 38.3 1.98 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.214 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.482 ' CD1' HD12 ' A' ' 14' ' ' LEU . 33.6 mt -62.09 -55.78 25.53 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.814 0.816 . . . . 0.0 110.476 -179.262 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.634 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -96.28 33.94 1.68 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.254 -1.339 . . . . 0.0 112.088 -179.796 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.634 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 12.2 mm-40 -153.77 15.7 0.5 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 120.652 0.263 . . . . 0.0 110.852 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -175.75 -36.75 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.208 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.47 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . 1.1 m-80 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.852 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.3 mtp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 120.8 0.334 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 p -112.14 -15.04 13.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.245 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.63 113.41 19.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.741 0.305 . . . . 0.0 110.716 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.6 13.8 22.51 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.431 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.58 -34.88 0.35 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.876 0.369 . . . . 0.0 111.072 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.422 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -63.93 163.57 11.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.145 0.498 . . . . 0.0 110.952 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.491 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 3.2 m-85 -84.58 -161.33 0.55 Allowed 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.493 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -72.43 -165.53 0.2 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.168 0.509 . . . . 0.0 112.051 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.573 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 3.3 t -127.78 44.46 2.93 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.465 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.646 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.1 mt-10 -126.92 177.54 6.55 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.201 -178.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.788 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -154.03 153.58 32.18 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.599 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 16.2 t -75.41 83.48 2.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.376 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.788 ' HG3' HD23 ' A' ' 14' ' ' LEU . 17.5 mtp180 -77.04 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.708 0.29 . . . . 0.0 111.768 -178.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -70.8 -21.27 62.49 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.49 0.662 . . . . 0.0 110.337 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.614 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -54.22 -47.91 71.65 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.656 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.2 -15.12 0.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.192 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.23 31.05 1.77 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.532 0.682 . . . . 0.0 110.67 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 m 71.41 18.29 5.57 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.955 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.64 -91.15 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.929 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.455 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -115.42 -60.86 1.82 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.052 0.93 . . . . 0.0 112.198 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.714 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 64.9 83.89 0.16 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.104 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 10.8 tpt180 -53.95 -16.85 2.08 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.698 -178.096 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.617 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.0 m-85 -138.16 51.25 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.322 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.89 123.61 1.22 Allowed Glycine 0 CA--C 1.517 0.204 0 CA-C-N 115.91 -0.586 . . . . 0.0 113.492 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 74.16 -19.52 0.35 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.172 0.589 . . . . 0.0 112.405 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.68 16.49 10.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.16 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.617 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.0 p -80.54 131.45 35.54 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 122.169 0.985 . . . . 0.0 113.559 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.428 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -130.96 -16.96 3.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.252 179.347 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.491 ' CD1' ' HB3' ' A' ' 10' ' ' TYR . 88.1 m-85 -158.06 -85.0 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.527 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.701 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -34.43 109.01 0.07 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.082 -177.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.714 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.52 -134.08 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 O-C-N 123.259 0.349 . . . . 0.0 110.388 -179.425 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.451 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -50.7 -111.05 0.01 OUTLIER Glycine 0 C--N 1.355 1.59 0 CA-C-N 118.58 0.627 . . . . 0.0 113.027 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.452 ' CD2' ' HG3' ' A' ' 38' ' ' GLU . 1.8 tp -75.38 -82.95 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.646 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 68.62 95.87 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 121.036 -0.602 . . . . 0.0 113.362 178.536 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 4.7 mt-10 -139.86 32.41 2.0 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.079 -0.56 . . . . 0.0 110.637 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.437 HD12 ' C ' ' A' ' 12' ' ' THR . 1.8 mt -42.41 -32.1 0.49 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.125 0.488 . . . . 0.0 111.71 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.573 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -120.06 41.96 3.06 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.401 179.166 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.605 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 12.6 mm-40 -158.78 37.36 0.22 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.985 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 41' ' ' GLN . . . 72.73 139.47 0.05 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.377 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 26.1 p30 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.086 179.92 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.8 0.333 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.4 p -122.58 -33.38 3.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.333 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.77 66.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.91 0.385 . . . . 0.0 110.865 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 8' ' ' SER . 0.8 OUTLIER -70.81 171.06 11.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.171 -179.763 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.403 ' HB2' ' O ' ' A' ' 7' ' ' SER . 0.4 OUTLIER 68.97 -62.49 0.4 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.233 179.938 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.5 tpp180 -59.4 157.2 11.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.142 0.496 . . . . 0.0 110.763 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.479 ' CB ' ' CE1' ' A' ' 32' ' ' PHE . 3.9 m-85 -81.21 -162.71 0.52 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.746 -179.661 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.91 -167.15 0.35 Allowed 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.515 -178.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.621 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 2.1 t -119.87 13.99 12.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.583 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.605 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.9 mt-10 -96.53 -168.4 1.72 Allowed 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -178.297 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.631 HD22 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -168.99 153.54 5.67 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.441 0.639 . . . . 0.0 112.221 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.627 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.1 t -73.28 82.0 1.36 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.329 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.629 ' HG3' HD23 ' A' ' 14' ' ' LEU . 4.2 mtp85 -72.67 -98.47 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -178.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -75.4 -23.61 57.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.845 0.831 . . . . 0.0 110.086 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.594 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.1 -47.04 54.0 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.819 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.62 -11.31 0.05 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.834 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -97.6 33.03 2.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.585 0.707 . . . . 0.0 110.529 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.05 16.51 8.67 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.703 179.567 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -91.31 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.98 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.503 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -111.05 -63.96 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.957 0.884 . . . . 0.0 111.543 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.702 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.3 m 64.33 83.01 0.17 Allowed 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.98 -1.464 . . . . 0.0 109.382 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.503 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 2.2 tpt85 -50.92 -20.41 1.32 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.736 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.615 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 21.6 m-85 -142.39 55.92 1.44 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.702 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.85 -32.75 0.07 OUTLIER Glycine 0 N--CA 1.464 0.523 0 N-CA-C 115.677 1.031 . . . . 0.0 115.677 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.3 -17.04 13.25 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 118.337 1.068 . . . . 0.0 111.694 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.423 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.6 OUTLIER -126.08 25.9 6.63 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.226 -178.391 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.615 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 30.3 p -82.14 126.26 31.83 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.219 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -14.91 3.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.57 -1.65 . . . . 0.0 110.12 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.479 ' CE1' ' CB ' ' A' ' 10' ' ' TYR . 93.9 m-85 -158.83 -82.12 0.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.19 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.698 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -35.33 108.53 0.07 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.827 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -168.74 -136.74 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.05 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.448 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -50.52 -112.08 0.01 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.365 0.53 . . . . 0.0 113.469 179.555 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -76.68 -81.86 0.08 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.769 0.318 . . . . 0.0 110.271 -179.858 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.605 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 61.73 88.77 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 121.307 -0.473 . . . . 0.0 113.677 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.534 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 4.2 mt-10 -131.94 30.82 4.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.461 -0.37 . . . . 0.0 110.983 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.514 ' HG ' ' CD1' ' A' ' 14' ' ' LEU . 4.9 mt -39.1 -33.39 0.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.621 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -123.57 33.98 5.2 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.432 179.716 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 62.3 mm-40 -160.45 61.84 0.32 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.443 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.78 -8.15 13.85 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.6 t30 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.169 -0.92 . . . . 0.0 110.77 179.767 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.0 ttt . . . . . 0 N--CA 1.489 1.483 0 CA-C-O 120.688 0.28 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.09 142.19 28.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.774 179.548 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.5 p -85.67 140.0 30.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.589 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.9 m -156.55 -53.68 0.08 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.26 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.2 p -93.98 46.55 1.18 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.545 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.97 179.14 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.473 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.459 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.2 m-85 -75.24 -164.02 0.28 Allowed 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.583 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.419 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -67.14 -163.72 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.184 0.516 . . . . 0.0 111.558 -178.417 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.782 HG21 ' HG3' ' A' ' 41' ' ' GLN . 5.1 t -137.11 31.64 2.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.775 -178.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.683 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -123.25 -170.49 2.12 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.686 -178.605 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.683 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -169.47 157.59 7.39 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.067 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.666 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.3 t -75.31 83.08 2.43 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.347 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.631 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -74.98 -99.58 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.476 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 t -75.71 -22.93 56.14 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.89 0.852 . . . . 0.0 109.991 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.642 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -51.67 -45.37 63.39 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.05 -1.432 . . . . 0.0 111.735 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.0 t -49.2 -16.9 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.292 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -100.91 34.39 2.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.601 0.715 . . . . 0.0 110.502 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 15.58 10.15 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.081 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.19 -17.36 70.01 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 121.128 -0.558 . . . . 0.0 114.082 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.581 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 173.73 -71.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.605 0.717 . . . . 0.0 112.541 -178.975 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.714 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.32 80.39 0.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.653 -178.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.469 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 5.7 tpp85 -53.47 -16.94 1.65 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.378 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.729 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.6 m-85 -142.55 47.61 1.57 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.078 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.424 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -36.82 128.49 1.09 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.122 -0.561 . . . . 0.0 113.494 -179.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 73.38 -25.22 0.19 Allowed 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 27' ' ' GLY . 9.1 ttpt -115.41 5.28 14.51 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.557 ' N ' ' O ' ' A' ' 26' ' ' TYR . 7.4 p -69.95 124.19 23.41 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -177.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.462 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -115.75 -22.34 9.19 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.398 -1.273 . . . . 0.0 109.408 178.895 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.469 ' HB3' ' H ' ' A' ' 13' ' ' GLU . 89.9 m-85 -159.97 -84.74 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.019 -179.254 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.729 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -27.03 104.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.398 0.679 . . . . 0.0 112.688 -178.457 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.714 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.56 -138.75 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.045 -179.704 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.555 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -44.15 -94.6 0.01 OUTLIER Glycine 0 C--N 1.346 1.131 0 CA-C-N 118.151 0.432 . . . . 0.0 113.636 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.547 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 0.6 OUTLIER -104.13 -85.68 0.46 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.542 . . . . 0.0 110.901 -178.801 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.675 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 63.29 88.71 0.04 OUTLIER Glycine 0 N--CA 1.44 -1.073 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.041 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.547 ' HG3' ' HG ' ' A' ' 36' ' ' LEU . 2.7 mt-10 -139.83 40.23 1.99 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.984 -0.608 . . . . 0.0 109.647 178.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.471 HD12 HD12 ' A' ' 14' ' ' LEU . 7.4 mt -76.33 -15.28 60.01 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.683 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.62 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -132.68 47.05 2.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.38 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.782 ' HG3' HG21 ' A' ' 12' ' ' THR . 11.6 mm100 -154.51 -67.28 0.13 Allowed 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 120.983 0.42 . . . . 0.0 110.816 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 66.43 11.04 7.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.525 -179.689 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 m120 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.832 179.83 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.545 ' O ' HG23 ' A' ' 5' ' ' THR . 1.5 mmt . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 120.601 0.238 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.545 HG23 ' O ' ' A' ' 4' ' ' MET . 0.5 OUTLIER -171.06 -80.09 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.198 179.686 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.4 p -109.59 87.86 2.61 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.932 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 26.2 p -85.66 1.78 47.95 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.674 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.412 ' H ' ' H ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -169.04 -15.53 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' H ' ' H ' ' A' ' 8' ' ' SER . 0.0 OUTLIER 69.83 -171.27 0.17 Allowed 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 120.782 0.325 . . . . 0.0 110.689 -179.606 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.559 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.6 m-85 -78.12 -158.09 0.12 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.704 -178.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -164.94 0.49 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.169 0.509 . . . . 0.0 110.741 -178.255 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.597 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 3.2 t -130.86 44.24 2.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.326 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.651 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -121.98 -174.53 2.9 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.965 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.808 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -158.32 132.18 7.81 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.475 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.692 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 49.1 t -64.73 87.85 0.06 Allowed 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.808 ' HG3' HD23 ' A' ' 14' ' ' LEU . 32.5 mtp180 -83.91 -103.73 0.05 OUTLIER 'General case' 0 C--N 1.347 0.464 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -66.06 -23.54 66.55 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.932 0.872 . . . . 0.0 109.98 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.54 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.4 m-85 -51.81 -50.23 61.21 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.068 -1.424 . . . . 0.0 112.285 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.562 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 20.5 p -55.4 -35.43 65.32 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.772 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.7 tt0 -62.81 -41.23 99.21 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.976 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 13.2 p 152.94 13.52 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.203 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.12 -91.97 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.421 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.556 ' HE ' ' HD3' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -120.43 -63.08 1.39 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.971 0.891 . . . . 0.0 112.653 -178.046 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.739 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 70.64 79.67 0.17 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.154 -1.385 . . . . 0.0 108.698 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -54.4 -12.08 0.63 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.499 -178.635 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.597 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 12.3 m-85 -142.84 51.07 1.42 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.525 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.42 118.15 0.69 Allowed Glycine 0 CA--C 1.521 0.42 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.921 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 79.98 -23.17 0.25 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -118.27 13.69 13.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 14.3 p -77.73 130.77 37.17 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -176.757 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.03 -19.06 4.47 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.129 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.559 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 94.1 m-85 -158.79 -85.64 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.448 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.597 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -28.42 101.18 0.02 OUTLIER 'General case' 0 C--N 1.35 0.604 0 O-C-N 123.239 0.337 . . . . 0.0 110.987 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.739 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -167.05 -156.72 0.22 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.147 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.46 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -44.96 110.64 0.43 Allowed Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 116.481 -0.327 . . . . 0.0 113.231 178.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.526 ' CD2' ' HG3' ' A' ' 38' ' ' GLU . 0.9 OUTLIER 54.05 -92.13 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.541 -0.063 . . . . 0.0 111.075 179.107 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.636 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 66.15 94.61 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.715 0 CA-C-O 121.482 0.49 . . . . 0.0 113.905 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.526 ' HG3' ' CD2' ' A' ' 36' ' ' LEU . 3.5 mt-10 -138.59 43.22 2.14 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.388 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.687 ' CG ' HD12 ' A' ' 14' ' ' LEU . 2.0 mt -53.98 -25.59 21.68 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.863 0.363 . . . . 0.0 111.897 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.635 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -124.19 39.23 4.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.587 179.547 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.635 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 12.6 mm100 -159.18 46.01 0.28 Allowed 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.792 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.98 -80.82 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.722 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.184 -0.912 . . . . 0.0 111.099 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.884 0.373 . . . . 0.0 111.588 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.8 t -156.92 74.72 0.81 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.861 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.8 p -78.27 123.51 27.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.65 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 p -105.17 69.8 0.87 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.888 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 84.5 p -173.54 -52.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.049 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -63.91 164.01 11.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.11 0.481 . . . . 0.0 110.592 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.609 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.8 m-85 -74.43 -163.78 0.22 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.26 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -68.92 -167.61 0.11 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.365 0.602 . . . . 0.0 111.588 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.599 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 1.6 t -122.98 3.98 9.36 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.956 -178.833 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.676 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 0.6 OUTLIER -87.46 179.26 6.6 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.455 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.601 HD12 HD11 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -159.87 164.98 33.12 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 121.271 0.558 . . . . 0.0 111.929 -179.603 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.616 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 37.6 t -86.82 80.47 8.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.136 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.542 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -74.6 -101.84 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.878 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.7 t -66.9 -19.05 65.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.44 0.638 . . . . 0.0 110.052 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.687 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -60.3 -46.5 89.66 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.415 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -14.46 0.19 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.538 -179.191 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.17 32.97 2.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.482 0.658 . . . . 0.0 110.287 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.56 16.11 8.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.983 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.15 -91.03 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.704 -0.76 . . . . 0.0 113.095 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.63 -60.13 1.91 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.627 0.727 . . . . 0.0 111.928 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.741 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 63.64 77.76 0.31 Allowed 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.383 -1.28 . . . . 0.0 108.611 -178.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.422 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 3.5 tpt180 -49.81 -22.99 1.63 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.267 -178.064 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.591 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 21.1 m-85 -137.16 48.22 2.08 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.6 125.66 1.3 Allowed Glycine 0 CA--C 1.519 0.297 0 CA-C-N 115.896 -0.593 . . . . 0.0 114.197 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.06 -23.54 0.24 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 111.944 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -117.37 5.58 12.58 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.291 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 26' ' ' TYR . 16.8 p -71.48 125.08 26.11 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.658 0.742 . . . . 0.0 112.555 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.417 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -119.51 -18.49 8.45 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.829 179.566 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.609 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 96.9 m-85 -159.55 -79.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.978 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.637 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -37.88 110.91 0.14 Allowed 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.289 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.741 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.47 -121.1 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.069 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.471 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -56.09 -102.77 0.01 OUTLIER Glycine 0 C--N 1.356 1.661 0 O-C-N 122.011 -0.431 . . . . 0.0 113.255 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.518 HD12 ' H ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -94.15 -54.92 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.037 0.446 . . . . 0.0 110.275 179.863 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.676 ' CA ' ' HA ' ' A' ' 13' ' ' GLU . . . 54.68 24.43 32.51 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.653 178.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -83.79 37.01 0.57 Allowed 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.601 HD11 HD12 ' A' ' 14' ' ' LEU . 23.5 mt -43.88 -65.45 0.5 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.957 0.884 . . . . 0.0 111.077 179.236 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.662 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -85.82 36.2 0.65 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.582 -1.644 . . . . 0.0 111.727 -179.184 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.662 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 9.1 mm100 -158.33 70.53 0.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.75 0.31 . . . . 0.0 110.594 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.47 -7.96 11.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.053 179.815 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 120.795 0.331 . . . . 0.0 111.357 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.8 p -126.47 -69.74 0.75 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.637 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.9 p -127.9 32.39 4.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.531 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 8' ' ' SER . 6.4 m 53.47 22.51 2.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.206 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.402 ' HB3' ' O ' ' A' ' 7' ' ' SER . 8.5 t 78.38 -16.76 0.63 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.02 164.7 0.21 Allowed 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.406 0.622 . . . . 0.0 111.469 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.458 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.7 m-85 -84.59 -161.15 0.53 Allowed 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.833 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 1.0 OUTLIER -68.64 -167.93 0.11 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.941 -178.426 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.677 ' HB ' ' HD2' ' A' ' 40' ' ' ARG . 6.2 t -119.36 -2.47 10.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.836 -178.73 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.749 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -80.35 -168.88 1.85 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.913 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.953 HD12 HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -165.86 151.99 9.34 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.34 0.591 . . . . 0.0 112.339 -178.451 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.717 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 7.8 t -70.31 83.15 0.55 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.257 178.942 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.773 ' HG2' HD23 ' A' ' 14' ' ' LEU . 2.9 mmm-85 -77.29 -101.69 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.345 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 t -69.92 -23.32 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.771 0.796 . . . . 0.0 110.271 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.746 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -55.37 -44.57 76.18 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.685 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.9 t -46.59 -13.92 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.72 -179.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.58 30.95 1.63 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.493 0.663 . . . . 0.0 110.502 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.42 18.9 7.79 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.55 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.72 -90.65 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.932 -0.652 . . . . 0.0 113.639 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.423 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -113.12 -60.39 1.89 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.089 0.947 . . . . 0.0 112.219 -178.521 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.626 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.5 m 65.86 84.65 0.15 Allowed 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.854 -1.521 . . . . 0.0 108.116 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.644 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -50.39 -17.77 0.53 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.241 -178.04 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.714 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 20.1 m-85 -136.67 51.21 2.0 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.83 120.43 0.85 Allowed Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 114.299 -178.843 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.39 -17.59 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.0 0.52 . . . . 0.0 112.048 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.13 19.8 8.27 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.446 -179.369 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.714 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.3 p -81.57 122.61 27.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -177.536 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -115.44 -19.96 10.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.946 -1.479 . . . . 0.0 109.298 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.458 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 90.8 m-85 -156.99 -128.9 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.201 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.644 ' HB1' ' HG2' ' A' ' 25' ' ' ARG . . . 45.29 -157.49 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 121.138 0.494 . . . . 0.0 111.783 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.746 ' HA ' ' CE2' ' A' ' 18' ' ' TYR . 0.4 OUTLIER 78.71 -147.73 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.616 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.57 -161.26 0.51 Allowed Glycine 0 C--N 1.35 1.351 0 CA-C-O 121.237 0.354 . . . . 0.0 113.73 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.578 ' O ' HD21 ' A' ' 14' ' ' LEU . 5.8 tt -55.02 116.57 2.84 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.174 -0.513 . . . . 0.0 111.82 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.717 ' HA2' HD21 ' A' ' 14' ' ' LEU . . . -126.9 -106.63 1.44 Allowed Glycine 0 N--CA 1.439 -1.151 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.336 177.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 61.54 9.76 2.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 178.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.953 HD12 HD12 ' A' ' 14' ' ' LEU . 27.5 mt -38.9 -63.59 0.51 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.294 0.569 . . . . 0.0 112.216 -179.601 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.677 ' HD2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -79.45 24.7 0.35 Allowed 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.179 -179.528 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.607 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 3.3 mt-30 -155.64 70.53 0.72 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.871 0.367 . . . . 0.0 110.443 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -40.26 143.19 0.32 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.79 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.821 -179.989 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.762 0.315 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.8 t -83.59 129.56 34.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.882 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.4 p -85.08 147.16 26.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.42 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.88 44.62 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.475 179.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.5 p -176.09 -63.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.602 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.426 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER 67.3 157.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.216 0.531 . . . . 0.0 110.936 179.798 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.605 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.7 m-85 -80.64 -161.21 0.36 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.336 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.21 -167.03 0.37 Allowed 'General case' 0 N--CA 1.44 -0.925 0 CA-C-O 121.272 0.558 . . . . 0.0 111.178 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.844 HG21 ' HG3' ' A' ' 41' ' ' GLN . 3.3 t -127.38 19.72 6.83 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.103 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.792 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.2 mt-10 -100.99 -169.7 1.74 Allowed 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -178.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.9 HD12 ' CD1' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -164.06 156.11 16.84 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.718 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.788 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 26.5 t -76.39 87.58 3.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.237 178.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.685 ' HG2' ' CD2' ' A' ' 14' ' ' LEU . 2.1 mmm-85 -74.9 -104.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.3 t -74.65 -17.09 60.74 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 121.76 0.79 . . . . 0.0 110.587 -179.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.6 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.6 m-85 -56.16 -42.3 76.8 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.12 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -25.6 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.934 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.46 ' O ' ' CB ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -66.5 -44.08 83.59 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.445 179.456 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.46 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 33.8 p 153.09 19.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.072 179.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.99 -95.84 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.694 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.484 ' HD3' ' C ' ' A' ' 24' ' ' CYS . 0.0 OUTLIER -115.56 -58.27 2.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.909 0.862 . . . . 0.0 112.608 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.753 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.2 m 68.92 82.64 0.17 Allowed 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 113.736 -1.575 . . . . 0.0 107.535 -176.702 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.64 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 5.5 tpp85 -47.02 -21.0 0.17 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.418 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.648 ' HB2' ' CA ' ' A' ' 30' ' ' CYS . 21.0 m-85 -140.38 54.35 1.62 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.753 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.93 -30.23 0.04 OUTLIER Glycine 0 N--CA 1.467 0.744 0 N-CA-C 115.924 1.13 . . . . 0.0 115.924 -177.167 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -114.17 -12.7 12.47 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.988 0.894 . . . . 0.0 111.283 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.438 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -131.61 31.08 4.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.525 -178.574 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.648 ' CA ' ' HB2' ' A' ' 26' ' ' TYR . 30.8 p -86.01 108.68 18.34 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -15.16 13.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.022 -1.444 . . . . 0.0 108.335 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.605 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 96.3 m-85 -157.28 -133.21 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.205 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.613 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 45.8 -156.34 0.03 OUTLIER 'General case' 0 N--CA 1.458 -0.071 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.788 ' CD2' ' HA ' ' A' ' 15' ' ' CYS . 0.3 OUTLIER 76.9 -165.36 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.882 179.573 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 36' ' ' LEU . . . -59.11 108.24 1.53 Allowed Glycine 0 C--N 1.34 0.778 0 CA-C-N 115.84 -0.618 . . . . 0.0 113.507 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.887 HD23 ' N ' ' A' ' 37' ' ' GLY . 3.1 tt 51.41 161.09 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.756 0.789 . . . . 0.0 111.557 178.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.887 ' N ' HD23 ' A' ' 36' ' ' LEU . . . 162.6 97.58 0.12 Allowed Glycine 0 N--CA 1.433 -1.544 0 CA-C-N 115.124 -0.944 . . . . 0.0 113.019 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.513 ' HB3' ' H ' ' A' ' 42' ' ' ALA . 1.8 mt-10 -140.53 43.46 1.87 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.9 ' CD1' HD12 ' A' ' 14' ' ' LEU . 1.1 mt -70.17 -12.86 61.9 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.856 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.593 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -131.03 29.64 4.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.024 -179.786 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.844 ' HG3' HG21 ' A' ' 12' ' ' THR . 26.4 mm-40 -153.34 -58.61 0.13 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.159 0.504 . . . . 0.0 111.392 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.513 ' H ' ' HB3' ' A' ' 38' ' ' GLU . . . 60.47 113.2 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.914 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.291 -0.861 . . . . 0.0 110.826 -179.72 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.6 ppp? . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.9 p -64.33 124.92 22.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.446 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.577 HG23 ' H ' ' A' ' 7' ' ' SER . 0.4 OUTLIER -136.05 -68.87 0.49 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.716 179.388 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.577 ' H ' HG23 ' A' ' 6' ' ' THR . 16.8 m 53.51 17.05 1.04 Allowed 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.91 -49.06 0.11 Allowed 'General case' 0 C--N 1.335 -0.052 0 CA-C-O 120.877 0.37 . . . . 0.0 111.166 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -81.37 151.15 28.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.058 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.594 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.9 m-85 -85.16 -163.16 0.79 Allowed 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.475 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 18.9 mttt -67.64 -162.88 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 121.6 0.714 . . . . 0.0 111.344 -179.105 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.504 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 3.4 t -126.75 1.99 6.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.901 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.778 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -82.62 -169.11 2.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.529 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.75 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -162.2 155.23 20.21 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.811 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.738 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 36.0 t -77.72 85.27 4.03 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.75 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -71.48 -101.74 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.158 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 t -77.07 -23.12 51.97 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.001 0.905 . . . . 0.0 110.076 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.564 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -47.33 -51.39 19.53 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.277 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.78 -12.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.08 34.66 1.89 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.508 0.671 . . . . 0.0 110.347 179.398 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.32 16.65 9.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.359 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.2 -90.9 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.809 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.489 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -112.2 -65.33 1.19 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.585 0.707 . . . . 0.0 111.685 -179.102 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.742 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 64.82 81.8 0.2 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.024 -178.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.616 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 4.9 tpp85 -55.6 -13.61 1.69 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.049 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.725 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 15.5 m-30 -139.63 52.3 1.72 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.513 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.26 117.41 0.59 Allowed Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.114 -0.565 . . . . 0.0 114.333 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 78.95 -18.32 0.52 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -121.27 10.24 10.57 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.797 -179.16 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.562 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 16.5 p -74.66 130.94 40.43 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -177.058 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.468 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -132.21 -14.76 2.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.092 177.954 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.596 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 97.1 m-85 -158.89 -81.77 0.05 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.725 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -37.29 102.56 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 111.192 -177.543 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.742 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.48 -154.99 0.22 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.327 -179.062 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.551 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -62.69 97.63 0.19 Allowed Glycine 0 CA--C 1.496 -1.135 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 178.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 59.21 164.18 0.05 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.336 0.589 . . . . 0.0 110.129 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.778 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 159.16 101.05 0.17 Allowed Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 120.17 -1.014 . . . . 0.0 113.187 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 2.9 mt-10 -136.18 45.89 2.33 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.199 -0.5 . . . . 0.0 110.271 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.723 HD11 HD12 ' A' ' 14' ' ' LEU . 1.5 mt -57.05 -20.48 24.95 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.54 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.547 ' O ' ' HD2' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -133.63 42.81 2.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.36 179.666 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 47.9 mt-30 -157.3 -49.29 0.07 Allowed 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.427 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 41' ' ' GLN . . . 171.59 84.39 0.0 OUTLIER 'General case' 0 C--O 1.231 0.081 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.147 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.301 -0.856 . . . . 0.0 111.035 -179.755 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.8 mtt . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.766 0.317 . . . . 0.0 111.29 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.549 HG22 ' H ' ' A' ' 7' ' ' SER . 4.3 m -67.91 157.38 35.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.995 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.469 ' O ' ' HB3' ' A' ' 7' ' ' SER . 0.7 OUTLIER -121.37 -5.45 9.35 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -179.633 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.549 ' H ' HG22 ' A' ' 5' ' ' THR . 23.3 t 74.54 -67.59 0.25 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.72 0.295 . . . . 0.0 111.14 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.4 m -156.05 89.66 1.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.644 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.414 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 19.0 tpp180 -72.71 161.74 30.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 0.0 111.314 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.514 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.2 m-85 -72.82 -162.77 0.11 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.304 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -162.83 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.022 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.899 HG21 ' HG3' ' A' ' 41' ' ' GLN . 3.4 t -132.92 24.85 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.365 -178.102 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.754 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -118.93 177.6 4.8 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -178.785 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.82 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -159.51 142.03 13.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.137 0.494 . . . . 0.0 112.205 -177.454 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.544 ' HA ' ' HD2' ' A' ' 34' ' ' HIS . 14.0 t -69.18 82.61 0.35 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.897 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.82 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -75.95 -99.62 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.704 0.288 . . . . 0.0 111.66 -178.96 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.4 t -72.97 -23.94 60.72 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.728 0.775 . . . . 0.0 109.974 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.557 ' CE1' ' CA ' ' A' ' 35' ' ' GLY . 3.0 m-85 -50.22 -47.15 55.01 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.923 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 p -49.12 -18.14 0.29 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.559 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.12 33.04 2.74 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.585 0.707 . . . . 0.0 110.62 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.99 17.28 8.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.292 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLY . . . . . 0.5 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.54 -19.8 73.18 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.725 -179.185 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 175.68 -69.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.716 0.769 . . . . 0.0 112.257 -179.259 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.735 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.7 m 64.26 81.48 0.21 Allowed 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.445 -1.252 . . . . 0.0 109.643 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.9 tpt180 -49.71 -19.46 0.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.112 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.568 ' O ' ' N ' ' A' ' 30' ' ' CYS . 24.2 m-85 -143.18 43.4 1.54 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.514 ' CA ' ' HB3' ' A' ' 24' ' ' CYS . . . -37.37 134.5 0.94 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.207 -0.52 . . . . 0.0 113.823 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 72.53 -24.67 0.19 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.996 0.427 . . . . 0.0 111.657 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.502 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -121.54 10.71 10.48 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.349 -179.001 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.568 ' N ' ' O ' ' A' ' 26' ' ' TYR . 25.6 p -79.8 118.67 21.8 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.473 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -110.34 -24.27 10.73 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.431 -1.258 . . . . 0.0 108.094 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.514 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 89.4 m-85 -161.14 -151.37 0.23 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.376 -1.284 . . . . 0.0 108.916 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 41.51 95.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 110.486 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.735 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.0 -143.22 0.06 Allowed 'General case' 0 CA--C 1.555 1.151 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.826 -177.88 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.557 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -63.94 118.95 14.38 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 122.171 -0.33 . . . . 0.0 113.248 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.638 HD23 ' N ' ' A' ' 37' ' ' GLY . 6.3 tt 46.55 -91.48 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.638 ' N ' HD23 ' A' ' 36' ' ' LEU . . . 52.16 77.71 0.13 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.619 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -129.58 42.95 3.21 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.235 -0.482 . . . . 0.0 109.727 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.74 HD12 HD12 ' A' ' 14' ' ' LEU . 3.2 mt -76.08 -13.56 60.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.622 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.453 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -130.26 24.04 5.2 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.722 179.761 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.899 ' HG3' HG21 ' A' ' 12' ' ' THR . 6.4 mm-40 -145.98 -45.32 0.2 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.126 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 62.97 165.37 0.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.712 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.934 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.1 mtm . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.663 0.268 . . . . 0.0 111.517 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m -71.08 160.44 32.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.849 0.357 . . . . 0.0 110.738 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 7' ' ' SER . 17.7 p -137.48 23.45 2.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.107 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.448 ' HB2' ' O ' ' A' ' 6' ' ' THR . 70.9 m 71.5 -83.29 0.03 OUTLIER 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.71 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.3 p -161.76 34.88 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.723 0.297 . . . . 0.0 111.047 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -84.18 158.46 21.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.076 0.465 . . . . 0.0 110.47 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.453 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.1 m-85 -71.56 -163.42 0.1 Allowed 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.405 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -61.79 -164.74 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.109 -178.112 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.558 ' OG1' ' HG3' ' A' ' 40' ' ' ARG . 6.6 t -134.11 36.4 3.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.637 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.588 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -127.52 -175.2 3.39 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 -178.825 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.721 HD12 HD21 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -169.04 148.4 4.07 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-O 121.189 0.518 . . . . 0.0 112.181 -179.24 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.607 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 15.2 t -69.42 78.22 0.39 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.507 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.428 ' HG3' HD23 ' A' ' 14' ' ' LEU . 8.8 mtt-85 -68.77 -95.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -178.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.8 t -77.91 -22.1 50.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.839 0.828 . . . . 0.0 110.257 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.713 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.4 m-85 -50.7 -43.49 57.78 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.494 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.4 p -56.3 -38.0 70.66 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.517 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -57.01 -47.56 80.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.223 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 0.3 OUTLIER 156.24 30.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.518 179.684 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.79 -96.49 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.954 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.413 ' HB3' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -120.12 -52.0 2.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.016 0.912 . . . . 0.0 111.755 -179.017 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.736 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 62.79 76.47 0.36 Allowed 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.835 -1.529 . . . . 0.0 108.281 -177.24 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 5.8 tpt180 -46.93 -21.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.375 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.555 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 27.7 m-85 -139.8 42.96 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.086 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.582 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.99 126.63 1.52 Allowed Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.937 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 86.03 -35.48 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.007 0.523 . . . . 0.0 111.874 -179.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 ttpt -114.81 9.27 16.25 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.052 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.555 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.2 p -72.5 116.12 12.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -176.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.432 HE22 ' HE2' ' A' ' 10' ' ' TYR . 0.2 OUTLIER -109.24 -21.97 12.3 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.114 177.074 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.453 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 86.2 m-85 -160.96 -157.49 0.52 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.553 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.606 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 41.94 102.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 178.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.736 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -165.28 -111.61 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.717 179.222 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.424 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -69.46 -119.71 0.03 OUTLIER Glycine 0 C--N 1.349 1.293 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.462 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -70.14 -73.6 0.16 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.943 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.588 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 58.79 91.57 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.263 178.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.462 ' HG3' ' HG ' ' A' ' 36' ' ' LEU . 3.0 mt-10 -134.24 46.45 2.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.211 -0.495 . . . . 0.0 110.558 179.338 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.721 HD21 HD12 ' A' ' 14' ' ' LEU . 4.2 mt -55.92 -19.96 14.12 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.558 ' HG3' ' OG1' ' A' ' 12' ' ' THR . 0.1 OUTLIER -141.35 24.56 2.1 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.187 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 8.7 mm-40 -144.14 11.92 1.57 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.417 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.423 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . . . -87.73 37.4 0.79 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.764 0.316 . . . . 0.0 111.772 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.2 t30 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.291 -0.861 . . . . 0.0 110.888 179.805 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.6 mtt . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 120.896 0.379 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.49 HG22 HH22 ' A' ' 40' ' ' ARG . 2.9 m 73.25 -63.54 0.43 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.332 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.7 p -130.68 -52.96 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.953 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 t 59.23 23.6 11.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.578 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.29 -65.22 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.741 0.305 . . . . 0.0 111.464 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.12 158.93 35.01 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.154 0.502 . . . . 0.0 110.759 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.573 ' HB3' ' CE2' ' A' ' 32' ' ' PHE . 3.9 m-85 -74.95 -164.12 0.27 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.179 -179.445 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HE3' ' HE2' ' A' ' 26' ' ' TYR . 9.3 mttm -66.57 -165.85 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.267 0.556 . . . . 0.0 111.355 -178.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.569 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 4.3 t -127.83 5.67 6.05 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.134 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.662 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 1.4 mt-10 -87.08 -176.47 5.72 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.137 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.637 HD13 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -160.9 149.4 16.26 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.379 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.625 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.2 t -72.49 86.32 1.16 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.71 178.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.598 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.11 -100.76 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -178.614 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 t -71.33 -23.19 61.89 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.702 0.763 . . . . 0.0 110.234 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.565 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.14 -50.12 49.78 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 114.595 -1.184 . . . . 0.0 112.181 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.47 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 88.8 p -56.01 -28.03 55.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.945 0.402 . . . . 0.0 112.058 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.543 ' O ' ' HB2' ' A' ' 21' ' ' SER . 2.2 tt0 -74.15 -39.81 63.03 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.91 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.543 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 35.0 t 159.36 10.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.536 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.48 -88.53 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.729 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.463 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -138.11 -57.81 0.66 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.144 0.973 . . . . 0.0 112.154 -178.123 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.738 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 74.22 77.37 0.12 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 113.217 -1.81 . . . . 0.0 108.381 -177.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 18.9 tpp180 -49.11 -16.92 0.17 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.725 -178.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.523 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 21.9 m-85 -142.95 48.96 1.48 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.61 126.66 1.79 Allowed Glycine 0 C--N 1.332 0.355 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.737 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.06 -18.44 0.44 Allowed 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 123.077 0.551 . . . . 0.0 112.202 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.79 17.88 6.79 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.57 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 23.7 p -85.01 115.61 22.93 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -177.114 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -112.09 -19.78 12.18 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.192 176.553 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.573 ' CE2' ' HB3' ' A' ' 10' ' ' TYR . 86.6 m-85 -160.75 -157.82 0.56 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.563 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.635 ' H ' ' HB2' ' A' ' 13' ' ' GLU . . . 42.34 98.25 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.143 0.177 . . . . 0.0 110.556 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.738 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.15 -142.23 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -178.241 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.515 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -56.87 -91.09 0.01 OUTLIER Glycine 0 C--N 1.35 1.329 0 N-CA-C 111.664 -0.575 . . . . 0.0 111.664 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.551 ' HB3' HD21 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -78.71 -152.53 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.409 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.662 ' CA ' ' HA ' ' A' ' 13' ' ' GLU . . . 137.29 -0.03 2.78 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 119.615 -1.279 . . . . 0.0 114.12 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -71.42 35.01 0.05 Allowed 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.544 -0.463 . . . . 0.0 111.89 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.619 HD11 HD12 ' A' ' 14' ' ' LEU . 41.9 mt -48.13 -69.38 0.12 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.54 0.686 . . . . 0.0 111.37 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.569 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.1 OUTLIER -75.91 20.71 0.18 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.528 -179.019 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 11.8 mt-30 -150.58 79.39 1.33 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 122.797 0.439 . . . . 0.0 110.466 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -44.71 146.45 0.76 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.731 0.301 . . . . 0.0 111.455 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 30.5 p30 . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.006 -179.929 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.404 ' O ' HG23 ' A' ' 5' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.869 0.366 . . . . 0.0 110.946 . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 4' ' ' MET . 0.7 OUTLIER -159.17 -68.0 0.08 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.096 -179.844 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.8 p -90.55 94.7 9.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.953 -179.882 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.36 113.44 25.32 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.85 179.924 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.6 m 59.21 89.74 0.06 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.778 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.557 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 10.7 tpp85 -77.71 155.69 31.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.421 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.6 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.0 m-85 -68.54 -159.21 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.249 -179.344 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LYS . . . . . 0.483 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -72.94 -164.03 0.15 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.865 -178.223 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 t -129.83 31.06 4.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.991 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.768 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.4 mt-10 -125.06 -167.52 1.69 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.218 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.812 HD12 HD21 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -166.25 155.88 11.79 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 112.061 -178.414 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.62 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.9 t -72.35 78.8 1.01 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.25 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.711 ' HG2' HD23 ' A' ' 14' ' ' LEU . 4.8 mmm180 -70.27 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.021 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.8 t -71.47 -20.65 62.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.668 0.746 . . . . 0.0 110.626 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.626 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -55.25 -47.05 75.98 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.798 -179.181 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -13.21 0.06 Allowed 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.282 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.41 31.49 1.97 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.625 0.726 . . . . 0.0 110.565 179.401 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.5 t 70.55 17.43 6.74 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.841 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -92.41 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.784 -0.722 . . . . 0.0 113.128 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HD3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -110.98 -61.78 1.64 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.982 0.896 . . . . 0.0 111.899 -178.999 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.74 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 63.71 81.39 0.21 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.046 -1.434 . . . . 0.0 108.684 -177.877 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.584 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -52.51 -19.87 2.55 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.285 -178.401 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.55 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.2 m-85 -137.36 49.55 2.0 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.149 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.504 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.82 119.98 0.8 Allowed Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.174 -0.467 . . . . 0.0 113.808 -179.188 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.14 -20.53 0.37 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 122.652 0.381 . . . . 0.0 111.627 -179.38 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.473 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -118.95 15.38 13.36 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.927 179.891 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.55 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 24.9 p -83.97 130.91 34.88 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.013 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -128.26 -18.38 4.09 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.056 -1.429 . . . . 0.0 110.201 178.763 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.6 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 95.3 m-85 -158.16 -74.48 0.09 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.644 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.685 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -41.43 105.12 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.796 -177.162 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.74 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.53 -133.33 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.732 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.431 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -68.64 -118.7 0.03 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.584 0.629 . . . . 0.0 111.736 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.845 HD23 ' H ' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -70.89 -170.17 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.286 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.845 ' H ' HD23 ' A' ' 36' ' ' LEU . . . 160.63 -84.64 0.12 Allowed Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.457 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.541 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 10.2 mt-10 39.55 26.96 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 179.423 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.812 HD21 HD12 ' A' ' 14' ' ' LEU . 1.5 mt -41.58 -37.4 1.12 Allowed 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.05 0.453 . . . . 0.0 111.822 -179.923 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.499 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -112.49 37.87 2.92 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.666 -179.236 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.541 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 5.0 mt-30 -146.59 -56.17 0.27 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.322 179.468 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 60.3 131.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.949 0.404 . . . . 0.0 111.351 -179.574 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' ASN . . . . . 0.468 ' HB2' ' OE1' ' A' ' 38' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.603 179.776 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.792 0.33 . . . . 0.0 111.167 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.7 m 56.98 73.65 0.45 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.872 -179.822 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.9 t -72.67 145.19 47.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.974 -179.83 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.93 -19.19 18.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.029 179.849 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -151.96 -46.72 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.62 179.901 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 68.7 174.8 0.28 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.412 -179.815 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.432 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.7 m-85 -71.5 -163.37 0.09 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.615 -179.974 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -68.07 -172.99 0.34 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.46 0.648 . . . . 0.0 112.037 -177.965 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.718 HG22 ' CB ' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -110.09 -22.32 11.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.469 -178.445 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.721 ' O ' ' HD2' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -79.4 -178.78 6.43 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.164 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.945 HD11 HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -166.25 150.31 7.69 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.067 -178.582 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.625 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 9.2 t -67.74 77.48 0.2 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.66 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -67.02 -95.35 0.0 OUTLIER 'General case' 0 C--N 1.344 0.334 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 -178.896 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -80.39 -23.07 40.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 121.819 0.818 . . . . 0.0 110.054 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -48.42 -44.95 35.64 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.338 -1.301 . . . . 0.0 111.632 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.93 -11.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.71 32.77 1.37 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.536 0.684 . . . . 0.0 110.341 179.432 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m 65.45 28.65 11.56 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.664 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.06 -97.46 0.1 OUTLIER Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 116.048 -0.524 . . . . 0.0 113.062 -179.561 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' HB3' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -104.09 -58.59 1.86 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.719 0.771 . . . . 0.0 111.851 -179.155 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.708 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 58.04 81.04 0.16 Allowed 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.177 -177.825 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 6.6 tpm_? -51.64 -18.49 1.19 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.148 -178.738 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.687 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 25.9 m-85 -139.71 44.92 1.93 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.487 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.424 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.91 128.88 1.54 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.804 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.37 -24.49 0.22 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.051 -179.6 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 27' ' ' GLY . 5.1 ttpt -121.45 15.97 11.27 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.771 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.2 p -87.16 114.37 23.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -176.475 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.427 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -110.14 -19.12 13.15 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.769 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.721 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 86.5 m-85 -160.66 -160.99 0.8 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.896 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.687 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 46.58 98.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.73 178.754 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.708 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.21 -111.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.81 179.369 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.424 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -73.45 -127.37 0.12 Allowed Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 -179.62 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' LEU . . . . . 0.494 ' HG ' ' H ' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -60.44 -74.68 0.07 Allowed 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.219 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.657 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 53.88 18.61 8.83 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.842 178.845 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.494 ' H ' ' HG ' ' A' ' 36' ' ' LEU . 7.1 mt-10 -92.6 43.19 1.12 Allowed 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.788 0.328 . . . . 0.0 110.218 179.157 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.945 HD12 HD11 ' A' ' 14' ' ' LEU . 4.5 mt -84.74 -20.52 30.98 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.427 -179.815 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.718 ' CB ' HG22 ' A' ' 12' ' ' THR . 0.0 OUTLIER -119.76 36.83 4.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.145 179.377 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.694 ' CG ' HG21 ' A' ' 12' ' ' THR . 15.1 mt-30 -148.52 -23.82 0.33 Allowed 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.59 -179.741 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 41' ' ' GLN . . . 68.18 125.25 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.931 0.396 . . . . 0.0 111.234 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.831 179.955 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 ttt . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 120.785 0.326 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.76 162.43 21.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.73 179.961 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.429 ' O ' ' HB2' ' A' ' 7' ' ' SER . 12.6 p -106.97 -28.28 10.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.12 -179.842 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 6' ' ' THR . 1.4 m 68.83 -63.94 0.34 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.903 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.9 p -169.05 43.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.371 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' HB2' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -56.68 177.02 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.939 -179.688 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 10' ' ' TYR . . . . . 0.564 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.8 m-85 -79.89 -162.73 0.46 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.784 179.898 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.21 -167.85 0.13 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.281 0.563 . . . . 0.0 111.701 -178.468 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.42 HG21 ' CG ' ' A' ' 41' ' ' GLN . 0.3 OUTLIER -119.12 -8.86 10.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.635 -178.711 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.855 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -81.95 -174.87 5.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.177 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.855 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -167.98 154.86 7.93 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 121.043 0.449 . . . . 0.0 111.506 -178.825 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 15' ' ' CYS . . . . . 0.621 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.8 t -72.47 83.31 1.09 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.226 179.541 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.848 ' HG3' HD23 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.86 -101.09 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -178.345 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -70.89 -20.35 62.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.783 0.801 . . . . 0.0 109.862 179.603 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.708 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -55.53 -48.02 75.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.659 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.6 t -45.88 -27.85 0.97 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.242 -178.897 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.595 ' O ' ' CB ' ' A' ' 21' ' ' SER . 0.7 OUTLIER -76.3 -31.89 58.45 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.067 -179.802 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.595 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 10.7 t 138.31 2.43 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.998 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.78 -38.5 10.06 Favored Glycine 0 C--N 1.332 0.311 0 N-CA-C 114.726 0.651 . . . . 0.0 114.726 -178.899 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.47 -62.35 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.703 0.763 . . . . 0.0 112.611 -178.396 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.702 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 65.64 80.88 0.22 Allowed 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.133 -1.394 . . . . 0.0 109.096 -177.72 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 1.3 tpm_? -50.25 -21.23 1.28 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.733 -179.319 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' TYR . . . . . 0.601 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 24.9 m-85 -140.62 55.07 1.59 Allowed 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.285 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.669 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.64 -35.39 0.12 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 115.61 1.004 . . . . 0.0 115.61 -177.224 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.69 -18.48 13.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 118.167 0.983 . . . . 0.0 112.085 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.22 28.52 6.02 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.952 -178.162 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' CYS . . . . . 0.593 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 31.8 p -87.24 116.85 25.6 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -177.549 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.488 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -120.42 -14.02 8.76 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.945 178.585 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.645 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.9 m-85 -158.33 -85.88 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -178.959 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.594 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -34.9 109.55 0.08 Allowed 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -177.84 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.708 ' CG ' ' CD2' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -162.95 -112.06 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.287 178.415 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.479 ' HA2' ' CE1' ' A' ' 18' ' ' TYR . . . -58.41 -100.15 0.01 OUTLIER Glycine 0 C--N 1.348 1.226 0 N-CA-C 112.728 -0.149 . . . . 0.0 112.728 -179.237 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -116.3 -42.13 3.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.838 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.659 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 37.66 72.09 0.19 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.847 179.478 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -119.12 41.06 3.16 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.955 -0.623 . . . . 0.0 110.227 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.549 HD12 HD12 ' A' ' 14' ' ' LEU . 52.9 mt -72.05 -31.36 66.07 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.472 0.653 . . . . 0.0 110.691 -179.88 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.482 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -119.51 45.35 2.15 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.729 179.813 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 1.9 mm-40 -146.78 -17.39 0.42 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.091 -179.929 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 66.79 166.23 0.21 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.815 0.34 . . . . 0.0 111.045 -179.654 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 m120 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.85 -179.926 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.444 -0.735 0 CA-C-O 121.302 0.572 . . . . 0.0 111.266 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.0 t -119.87 1.0 10.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.191 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.564 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -81.57 -173.74 4.57 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.384 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.806 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -161.12 147.92 14.94 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.857 -179.362 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.638 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 18.8 t -72.34 85.9 1.11 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.806 ' HG3' HD23 ' A' ' 14' ' ' LEU . 1.1 mtp85 -78.07 -101.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -71.66 -21.48 61.81 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.737 0.78 . . . . 0.0 110.047 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.592 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -52.99 -48.07 67.76 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.493 -1.231 . . . . 0.0 112.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.12 -12.8 0.09 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.843 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.39 32.96 2.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.473 0.654 . . . . 0.0 110.6 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 70.02 15.11 7.78 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.689 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.0 -88.62 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.954 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -114.93 -64.45 1.31 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.843 0.83 . . . . 0.0 112.153 -178.725 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.17 83.97 0.16 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.711 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.589 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 16.2 tpt85 -55.36 -14.1 1.72 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.439 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.699 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.7 m-85 -139.2 51.91 1.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.49 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.4 118.81 0.76 Allowed Glycine 0 CA--C 1.52 0.401 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.943 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.7 -14.97 0.73 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.736 0.414 . . . . 0.0 111.967 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.474 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -124.94 17.09 8.57 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.273 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.651 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 27.3 p -84.3 132.59 34.6 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.418 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -131.17 -17.36 3.05 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.65 -1.613 . . . . 0.0 110.38 178.827 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.487 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 82.8 m-85 -157.75 -85.79 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.699 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -33.26 105.57 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -177.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -161.99 -139.67 0.05 Allowed 'General case' 0 CA--C 1.557 1.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 -179.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -50.68 -113.53 0.01 OUTLIER Glycine 0 C--N 1.348 1.218 0 CA-C-N 118.118 0.417 . . . . 0.0 114.015 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.14 -75.19 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.96 0.409 . . . . 0.0 111.436 -179.323 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.564 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.447 -0.582 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.864 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.465 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.459 0 CA-C-O 120.956 0.407 . . . . 0.0 110.965 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.9 t -127.84 2.61 6.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.208 -179.413 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.664 ' CG ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -86.67 -174.03 4.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.454 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.59 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -169.01 156.51 7.32 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.554 0.692 . . . . 0.0 112.571 -179.201 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.658 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 5.1 t -71.17 84.02 0.73 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.692 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.523 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -70.04 -97.71 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.822 0.344 . . . . 0.0 111.504 -179.109 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -81.59 -19.82 41.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 122.055 0.931 . . . . 0.0 110.171 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.715 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -50.61 -51.12 51.61 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.388 -1.278 . . . . 0.0 112.567 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.11 -32.29 22.16 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.458 ' O ' ' CB ' ' A' ' 21' ' ' SER . 3.7 tt0 -68.16 -40.89 82.21 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.113 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 0.4 OUTLIER 158.64 18.63 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.93 -90.76 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 121.386 -0.435 . . . . 0.0 113.735 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 1.3 ttt180 -133.36 -57.15 0.9 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.123 0.963 . . . . 0.0 112.272 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.72 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 72.46 79.85 0.15 Allowed 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.369 -1.741 . . . . 0.0 108.531 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 12.0 tpt180 -50.96 -16.91 0.49 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.441 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.522 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 18.1 m-85 -140.91 49.9 1.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.83 126.02 1.42 Allowed Glycine 0 C--N 1.335 0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.212 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 70.96 -14.35 0.45 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.14 -0.53 . . . . 0.0 112.219 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -127.85 17.58 6.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 122.688 0.395 . . . . 0.0 111.299 -179.542 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' TYR . 26.6 p -87.37 107.28 18.46 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.507 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -103.67 -16.86 15.35 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.046 176.283 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.507 ' N ' ' OE1' ' A' ' 31' ' ' GLN . 97.6 m-85 -153.71 -138.79 0.08 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.793 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.665 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 51.75 -158.94 0.11 Allowed 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.334 -0.229 . . . . 0.0 111.093 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.72 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER 83.59 -147.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 178.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -61.39 -132.42 0.01 OUTLIER Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.262 0.465 . . . . 0.0 114.262 -178.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -37.22 -77.12 0.02 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.656 -0.772 . . . . 0.0 111.502 -179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.664 ' HA3' ' CG ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.451 -0.359 0 C-N-CA 121.275 -0.488 . . . . 0.0 113.937 179.695 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.444 -0.747 0 CA-C-O 121.06 0.457 . . . . 0.0 110.765 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.1 t -121.67 -3.92 9.25 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.447 -179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.804 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -79.91 -170.45 2.44 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.64 HD22 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -166.06 144.84 5.88 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.337 0.589 . . . . 0.0 111.899 -179.089 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.64 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -71.16 84.73 0.74 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.537 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.688 ' CD ' HD11 ' A' ' 36' ' ' LEU . 3.8 mtp180 -79.48 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -71.34 -18.91 62.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.548 0.689 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.692 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.8 m-85 -53.55 -48.08 69.44 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.943 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.52 -36.77 7.07 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.18 0.514 . . . . 0.0 111.747 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.526 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.6 tt0 -67.73 -38.17 83.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 14.4 t 150.53 -0.72 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.718 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -43.25 -41.11 4.85 Favored Glycine 0 C--N 1.332 0.342 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -178.26 -60.27 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.463 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 67.26 80.78 0.21 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.661 -176.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.613 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 3.9 tpp180 -52.52 -18.72 1.84 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.674 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.91 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 23.6 m-85 -137.09 49.76 2.02 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.09 122.22 0.85 Allowed Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.199 -0.524 . . . . 0.0 114.08 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 78.21 -25.81 0.19 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.643 0.777 . . . . 0.0 112.333 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -115.25 8.52 15.52 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.474 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.701 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 21.8 p -72.09 131.48 42.9 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.422 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -127.57 -17.73 4.53 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.299 179.202 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.53 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 91.0 m-85 -158.62 -84.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.91 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -33.26 107.12 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.27 -116.16 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.589 178.534 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.442 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -55.04 -103.22 0.01 OUTLIER Glycine 0 C--N 1.354 1.582 0 O-C-N 122.43 -0.169 . . . . 0.0 113.401 -178.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.763 HD12 ' H ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -100.45 -58.09 1.98 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.804 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.442 -0.962 0 CA-C-N 115.377 -0.829 . . . . 0.0 113.749 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.017 0.437 . . . . 0.0 111.628 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.55 41.12 3.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.125 -178.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.793 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.2 mt-10 -132.2 -168.36 2.03 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.793 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -164.21 142.05 7.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.148 0.499 . . . . 0.0 111.597 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.616 ' HA ' ' HD2' ' A' ' 34' ' ' HIS . 14.6 t -66.97 79.26 0.12 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.842 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.792 ' HG3' HD23 ' A' ' 14' ' ' LEU . 6.5 mtp85 -72.26 -97.96 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.626 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -74.59 -23.47 58.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.87 0.843 . . . . 0.0 109.958 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.6 m-85 -49.91 -48.58 51.6 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.456 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.56 -37.59 63.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.476 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.5 tt0 -58.43 -44.62 89.21 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 1.9 p 154.12 28.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.678 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.24 -95.15 0.08 OUTLIER Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.278 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.41 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -121.02 -54.01 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 122.05 0.929 . . . . 0.0 111.925 -178.586 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.74 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 64.05 78.96 0.27 Allowed 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.388 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.548 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -47.39 -21.51 0.32 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.443 -178.217 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.741 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 25.9 m-85 -133.45 47.68 2.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.538 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.11 120.76 0.94 Allowed Glycine 0 C--N 1.332 0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 114.109 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 81.51 -23.23 0.23 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.098 0.559 . . . . 0.0 112.221 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.51 19.51 9.61 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.245 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.648 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.7 p -84.43 127.48 34.04 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -176.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -123.16 -22.16 5.23 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.22 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.484 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 97.5 m-85 -160.54 -165.37 1.41 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.288 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.741 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 49.14 100.84 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.111 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.74 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -164.23 -109.81 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.092 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.423 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -75.66 -118.8 0.12 Allowed Glycine 0 C--N 1.349 1.252 0 CA-C-O 121.089 0.272 . . . . 0.0 113.024 -179.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -78.69 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.757 0.313 . . . . 0.0 111.202 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 C--N 1.333 0.389 0 CA-C-O 121.371 0.429 . . . . 0.0 113.972 179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HD2' ' HB2' ' A' ' 33' ' ' ALA . 9.4 mttt . . . . . 0 N--CA 1.45 -0.435 0 CA-C-O 121.198 0.523 . . . . 0.0 112.143 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.6 t -129.01 37.32 4.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.932 -178.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.66 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.2 mt-10 -118.67 -174.37 2.67 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.447 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.687 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -157.09 150.75 24.38 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.872 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.611 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -74.92 88.09 2.32 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.373 178.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.687 ' HG3' HD23 ' A' ' 14' ' ' LEU . 16.5 mtp180 -77.13 -99.88 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.2 t -73.06 -23.44 60.57 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.852 0.834 . . . . 0.0 110.061 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -49.54 -50.34 42.46 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.746 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 38.4 p -46.01 -15.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.268 -0.878 . . . . 0.0 113.353 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.1 OUTLIER -98.64 35.14 1.88 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.538 0.685 . . . . 0.0 110.961 -179.512 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 4.2 m 68.6 17.4 8.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.519 -1.218 . . . . 0.0 112.072 178.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.3 -88.25 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.25 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.44 -62.18 1.63 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.874 0.845 . . . . 0.0 111.563 -178.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.699 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.8 m 61.38 80.12 0.23 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.605 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -49.22 -21.47 0.8 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.037 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.684 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 19.6 m-85 -135.88 48.06 2.22 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.512 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.76 121.45 0.94 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 121.266 -0.492 . . . . 0.0 114.156 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.512 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 80.74 -25.55 0.17 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.239 0.615 . . . . 0.0 112.438 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -116.77 7.92 13.54 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.546 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.572 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.5 p -71.12 132.84 45.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.127 0.965 . . . . 0.0 113.557 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.74 -17.3 2.52 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 113.522 -1.672 . . . . 0.0 110.211 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.446 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 89.6 m-85 -157.98 -80.69 0.06 Allowed 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.684 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -40.41 109.72 0.12 Allowed 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.855 -177.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -169.51 -145.5 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.546 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -66.76 99.2 0.46 Allowed Glycine 0 C--N 1.345 1.06 0 O-C-N 122.042 -0.411 . . . . 0.0 112.3 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.747 HD23 ' N ' ' A' ' 37' ' ' GLY . 2.5 tt 54.9 169.13 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.298 0.57 . . . . 0.0 110.246 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.747 ' N ' HD23 ' A' ' 36' ' ' LEU . . . . . . . . 0 N--CA 1.431 -1.693 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.435 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.434 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.3 OUTLIER . . . . . 0 N--CA 1.449 -0.484 0 CA-C-O 121.281 0.563 . . . . 0.0 112.098 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.43 ' O ' ' O ' ' A' ' 37' ' ' GLY . 5.6 t -128.12 36.69 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.679 -178.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.571 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -121.46 -170.09 1.97 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.15 -179.329 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.835 HD23 ' HD3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -164.25 143.91 7.75 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.022 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.639 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 17.7 t -64.87 84.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.835 ' HD3' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.83 -100.88 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.675 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . 0.431 ' H ' ' HB3' ' A' ' 16' ' ' ARG . 6.1 t -69.69 -25.99 64.15 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.935 0.874 . . . . 0.0 109.913 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.1 m-85 -50.17 -53.04 30.5 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.309 -1.314 . . . . 0.0 111.238 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -46.67 -12.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.166 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.21 31.05 2.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.407 0.622 . . . . 0.0 110.667 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m 69.4 21.18 7.02 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.024 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.66 -92.75 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.059 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -64.18 1.2 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.917 0.865 . . . . 0.0 111.52 -179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.757 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.3 m 62.28 79.85 0.24 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.435 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.623 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 27.2 tpt180 -47.96 -20.31 0.32 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.12 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.766 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 17.8 m-85 -140.83 57.59 1.56 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.757 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -37.02 -35.08 0.12 Allowed Glycine 0 N--CA 1.465 0.601 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 -177.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.96 -16.66 13.06 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.321 1.06 . . . . 0.0 111.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 25.52 7.42 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.708 ' CA ' ' HB2' ' A' ' 26' ' ' TYR . 30.2 p -81.62 129.13 34.58 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.71 -15.4 2.09 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.589 -1.642 . . . . 0.0 110.253 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.538 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 81.2 m-85 -157.66 -82.33 0.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.766 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -37.75 102.98 0.03 OUTLIER 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.522 -177.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.706 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.93 -138.51 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.451 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.483 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -67.71 -163.95 2.4 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 118.312 0.505 . . . . 0.0 112.283 178.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.603 ' O ' HD21 ' A' ' 14' ' ' LEU . 7.8 tt -44.95 117.01 1.2 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.106 0.479 . . . . 0.0 110.321 179.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.432 ' O ' ' HG3' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.44 -1.036 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.424 ' HB2' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 121.365 0.602 . . . . 0.0 112.103 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.4 ' O ' ' O ' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -112.07 -26.66 8.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.968 -1.014 . . . . 0.0 112.795 -178.359 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.788 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -79.49 -175.41 4.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.417 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.762 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -167.86 152.0 6.37 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.47 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.661 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.5 t -70.31 84.07 0.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.997 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.761 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.35 -100.2 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.1 t -72.38 -23.21 61.08 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.736 0.779 . . . . 0.0 110.432 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.59 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -52.52 -45.34 66.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.876 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -49.77 -11.08 0.05 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.734 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -96.73 33.73 1.8 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.583 0.706 . . . . 0.0 110.324 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.6 m 66.91 18.7 10.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.668 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.31 -92.72 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.856 -0.688 . . . . 0.0 113.157 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.425 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -109.89 -64.12 1.29 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.783 0.801 . . . . 0.0 112.179 -178.799 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.699 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 65.73 81.95 0.19 Allowed 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.561 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -51.07 -19.1 0.98 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.188 -178.42 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.642 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 23.5 m-85 -141.23 46.44 1.73 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.507 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.26 127.91 1.68 Allowed Glycine 0 C--N 1.334 0.47 0 CA-C-N 116.009 -0.542 . . . . 0.0 113.915 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.22 -23.88 0.24 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.01 0.433 . . . . 0.0 111.713 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.5 OUTLIER -124.01 19.72 9.18 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.885 -179.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.0 p -89.1 113.37 24.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -176.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.42 ' C ' ' CD1' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -110.46 -19.35 12.97 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.112 176.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.641 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 91.8 m-85 -160.69 -153.69 0.33 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.376 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.642 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 40.91 95.91 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.052 0.141 . . . . 0.0 111.092 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.66 -136.19 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -178.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.511 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -62.38 -104.05 0.01 OUTLIER Glycine 0 C--N 1.352 1.445 0 CA-C-N 118.672 0.669 . . . . 0.0 112.307 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -62.05 -130.21 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 178.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.788 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.437 -1.275 0 C-N-CA 120.299 -0.953 . . . . 0.0 114.726 177.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.529 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.711 0 CA-C-O 121.167 0.508 . . . . 0.0 111.044 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.1 t -117.79 -7.58 10.95 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.32 -178.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.82 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -79.72 -175.51 4.89 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.281 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.773 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -163.24 150.31 12.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.399 -178.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.604 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 8.6 t -71.96 81.66 0.93 Allowed 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.773 ' HG3' HD23 ' A' ' 14' ' ' LEU . 40.7 mtt-85 -75.69 -99.53 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.638 -179.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -74.75 -21.3 59.42 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.556 0.693 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.617 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -54.14 -45.48 71.98 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.653 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.73 -17.66 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.673 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.67 35.71 2.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.645 0.736 . . . . 0.0 110.175 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 m 69.0 12.39 8.6 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.415 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.568 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -63.01 -17.17 58.42 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.935 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 171.24 -68.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 4.0 m 64.3 83.83 0.16 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.358 -178.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.597 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 11.9 tpt180 -55.73 -13.75 1.88 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.931 -1.031 . . . . 0.0 112.104 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.615 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.3 m-85 -139.74 52.6 1.7 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.71 121.01 0.88 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 113.694 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 71.82 -17.12 0.36 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.97 0.508 . . . . 0.0 112.055 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -120.46 19.75 11.97 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.278 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.1 p -87.0 131.75 33.99 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.411 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.9 OUTLIER -128.1 -20.91 3.7 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.72 178.61 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.544 ' CD2' ' O ' ' A' ' 13' ' ' GLU . 78.9 m-85 -155.71 -87.93 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.615 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -28.88 102.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -160.39 -137.29 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.653 -179.711 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.558 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -46.11 -103.53 0.01 OUTLIER Glycine 0 C--N 1.344 1.013 0 O-C-N 121.861 -0.524 . . . . 0.0 113.621 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.41 ' O ' ' CG ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -89.03 -92.53 0.12 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.523 -0.338 . . . . 0.0 110.435 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.82 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.446 -0.669 0 N-CA-C 114.552 0.581 . . . . 0.0 114.552 178.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.464 0 CA-C-O 121.192 0.52 . . . . 0.0 111.852 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.9 t -125.09 41.35 3.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.745 -178.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.568 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -131.7 -168.0 1.96 Allowed 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.661 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -163.86 145.95 9.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.196 0.522 . . . . 0.0 111.787 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.631 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 24.6 t -71.55 81.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.243 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.661 ' HG3' HD23 ' A' ' 14' ' ' LEU . 9.7 mtp180 -75.44 -97.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -178.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -73.98 -20.86 60.21 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 121.706 0.765 . . . . 0.0 110.493 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.631 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.0 m-85 -52.93 -44.38 66.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.936 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 93.2 p -47.47 -18.21 0.12 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.381 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.16 33.01 2.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.583 0.706 . . . . 0.0 110.443 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.1 t 67.0 17.15 10.48 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.875 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.54 -25.95 69.24 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.887 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.08 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.747 0.784 . . . . 0.0 112.255 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.704 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 2.8 m 57.51 84.5 0.1 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.721 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.5 tpp180 -53.41 -17.02 1.64 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.849 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.62 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 23.0 m-85 -136.52 47.55 2.18 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.55 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.72 119.96 0.77 Allowed Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.898 -0.592 . . . . 0.0 114.115 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 82.5 -27.78 0.12 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.981 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -118.67 21.2 12.64 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.242 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.62 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 32.0 p -86.5 127.18 34.85 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -176.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.88 -20.62 5.35 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.968 -1.469 . . . . 0.0 109.676 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.441 ' HB3' ' HB2' ' A' ' 11' ' ' LYS . 97.1 m-85 -160.87 -160.89 0.78 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.899 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 45.07 95.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.633 178.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.704 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -159.44 -116.04 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.876 179.418 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.467 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -64.64 -119.8 0.01 OUTLIER Glycine 0 C--N 1.35 1.328 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 6.9 tp -69.45 -74.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.568 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.446 -0.644 0 CA-C-N 115.891 -0.595 . . . . 0.0 114.084 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 mttp . . . . . 0 N--CA 1.445 -0.695 0 CA-C-O 121.168 0.509 . . . . 0.0 112.051 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 t -127.78 44.46 2.93 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.465 -179.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.646 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.1 mt-10 -126.92 177.54 6.55 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.201 -178.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.788 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -154.03 153.58 32.18 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.599 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 16.2 t -75.41 83.48 2.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.376 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.788 ' HG3' HD23 ' A' ' 14' ' ' LEU . 17.5 mtp180 -77.04 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.708 0.29 . . . . 0.0 111.768 -178.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -70.8 -21.27 62.49 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.49 0.662 . . . . 0.0 110.337 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.614 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -54.22 -47.91 71.65 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.656 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.2 -15.12 0.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.192 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.23 31.05 1.77 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.532 0.682 . . . . 0.0 110.67 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 m 71.41 18.29 5.57 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.955 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.64 -91.15 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.929 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.455 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -115.42 -60.86 1.82 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.052 0.93 . . . . 0.0 112.198 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.714 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 64.9 83.89 0.16 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.104 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 10.8 tpt180 -53.95 -16.85 2.08 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.698 -178.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.617 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.0 m-85 -138.16 51.25 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.89 123.61 1.22 Allowed Glycine 0 CA--C 1.517 0.204 0 CA-C-N 115.91 -0.586 . . . . 0.0 113.492 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 74.16 -19.52 0.35 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.172 0.589 . . . . 0.0 112.405 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.68 16.49 10.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.16 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.617 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.0 p -80.54 131.45 35.54 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 122.169 0.985 . . . . 0.0 113.559 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.428 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -130.96 -16.96 3.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.252 179.347 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.428 ' CD1' ' O ' ' A' ' 31' ' ' GLN . 88.1 m-85 -158.06 -85.0 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.701 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -34.43 109.01 0.07 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.082 -177.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.714 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.52 -134.08 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 O-C-N 123.259 0.349 . . . . 0.0 110.388 -179.425 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.451 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -50.7 -111.05 0.01 OUTLIER Glycine 0 C--N 1.355 1.59 0 CA-C-N 118.58 0.627 . . . . 0.0 113.027 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 1.8 tp -75.38 -82.95 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.646 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.442 -0.901 0 C-N-CA 121.036 -0.602 . . . . 0.0 113.362 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.443 -0.79 0 CA-C-O 121.149 0.5 . . . . 0.0 111.515 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 2.1 t -119.87 13.99 12.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.583 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.605 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.9 mt-10 -96.53 -168.4 1.72 Allowed 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -178.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.631 HD22 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -168.99 153.54 5.67 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.441 0.639 . . . . 0.0 112.221 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.627 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.1 t -73.28 82.0 1.36 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.329 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.629 ' HG3' HD23 ' A' ' 14' ' ' LEU . 4.2 mtp85 -72.67 -98.47 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -178.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -75.4 -23.61 57.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.845 0.831 . . . . 0.0 110.086 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.594 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.1 -47.04 54.0 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.819 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.62 -11.31 0.05 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.834 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -97.6 33.03 2.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.585 0.707 . . . . 0.0 110.529 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.05 16.51 8.67 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.703 179.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -91.31 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.98 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.503 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -111.05 -63.96 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.957 0.884 . . . . 0.0 111.543 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.702 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.3 m 64.33 83.01 0.17 Allowed 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.98 -1.464 . . . . 0.0 109.382 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.503 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 2.2 tpt85 -50.92 -20.41 1.32 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.736 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.615 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 21.6 m-85 -142.39 55.92 1.44 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.702 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.85 -32.75 0.07 OUTLIER Glycine 0 N--CA 1.464 0.523 0 N-CA-C 115.677 1.031 . . . . 0.0 115.677 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.3 -17.04 13.25 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 118.337 1.068 . . . . 0.0 111.694 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.423 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.6 OUTLIER -126.08 25.9 6.63 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.226 -178.391 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.615 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 30.3 p -82.14 126.26 31.83 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.219 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -14.91 3.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.57 -1.65 . . . . 0.0 110.12 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.479 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 93.9 m-85 -158.83 -82.12 0.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.19 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.698 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -35.33 108.53 0.07 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.827 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -168.74 -136.74 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.05 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.448 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -50.52 -112.08 0.01 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.365 0.53 . . . . 0.0 113.469 179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -81.86 0.08 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.769 0.318 . . . . 0.0 110.271 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.605 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.445 -0.753 0 C-N-CA 121.307 -0.473 . . . . 0.0 113.677 178.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.419 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER . . . . . 0 N--CA 1.45 -0.446 0 CA-C-O 121.184 0.516 . . . . 0.0 111.558 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 5.1 t -137.11 31.64 2.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.775 -178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.683 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -123.25 -170.49 2.12 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.686 -178.605 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.683 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -169.47 157.59 7.39 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.067 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.666 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.3 t -75.31 83.08 2.43 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.347 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.631 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -74.98 -99.58 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.476 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 t -75.71 -22.93 56.14 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.89 0.852 . . . . 0.0 109.991 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.642 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -51.67 -45.37 63.39 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.05 -1.432 . . . . 0.0 111.735 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.0 t -49.2 -16.9 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.292 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -100.91 34.39 2.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.601 0.715 . . . . 0.0 110.502 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 15.58 10.15 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.081 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.19 -17.36 70.01 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 121.128 -0.558 . . . . 0.0 114.082 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.581 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 173.73 -71.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.605 0.717 . . . . 0.0 112.541 -178.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.714 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.32 80.39 0.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.653 -178.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.469 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 5.7 tpp85 -53.47 -16.94 1.65 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.378 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.729 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.6 m-85 -142.55 47.61 1.57 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.424 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -36.82 128.49 1.09 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.122 -0.561 . . . . 0.0 113.494 -179.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 73.38 -25.22 0.19 Allowed 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 27' ' ' GLY . 9.1 ttpt -115.41 5.28 14.51 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.557 ' N ' ' O ' ' A' ' 26' ' ' TYR . 7.4 p -69.95 124.19 23.41 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -177.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.462 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -115.75 -22.34 9.19 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.398 -1.273 . . . . 0.0 109.408 178.895 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.469 ' HB3' ' H ' ' A' ' 13' ' ' GLU . 89.9 m-85 -159.97 -84.74 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.019 -179.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.729 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -27.03 104.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.398 0.679 . . . . 0.0 112.688 -178.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.714 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.56 -138.75 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.045 -179.704 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.555 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -44.15 -94.6 0.01 OUTLIER Glycine 0 C--N 1.346 1.131 0 CA-C-N 118.151 0.432 . . . . 0.0 113.636 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -104.13 -85.68 0.46 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.542 . . . . 0.0 110.901 -178.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.675 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.44 -1.073 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.041 179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.453 -0.311 0 CA-C-O 121.169 0.509 . . . . 0.0 110.741 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.2 t -130.86 44.24 2.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.326 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.651 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -121.98 -174.53 2.9 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.965 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.808 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -158.32 132.18 7.81 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.475 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.692 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 49.1 t -64.73 87.85 0.06 Allowed 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.808 ' HG3' HD23 ' A' ' 14' ' ' LEU . 32.5 mtp180 -83.91 -103.73 0.05 OUTLIER 'General case' 0 C--N 1.347 0.464 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -66.06 -23.54 66.55 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.932 0.872 . . . . 0.0 109.98 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.54 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.4 m-85 -51.81 -50.23 61.21 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.068 -1.424 . . . . 0.0 112.285 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.562 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 20.5 p -55.4 -35.43 65.32 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.772 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.7 tt0 -62.81 -41.23 99.21 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.976 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 13.2 p 152.94 13.52 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.203 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.12 -91.97 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.421 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.556 ' HE ' ' HD3' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -120.43 -63.08 1.39 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.971 0.891 . . . . 0.0 112.653 -178.046 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.739 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 70.64 79.67 0.17 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.154 -1.385 . . . . 0.0 108.698 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -54.4 -12.08 0.63 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.499 -178.635 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.597 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 12.3 m-85 -142.84 51.07 1.42 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.525 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.42 118.15 0.69 Allowed Glycine 0 CA--C 1.521 0.42 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.921 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 79.98 -23.17 0.25 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -118.27 13.69 13.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 14.3 p -77.73 130.77 37.17 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -176.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.03 -19.06 4.47 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.129 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.495 ' O ' ' HB2' ' A' ' 34' ' ' HIS . 94.1 m-85 -158.79 -85.64 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.448 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.597 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -28.42 101.18 0.02 OUTLIER 'General case' 0 C--N 1.35 0.604 0 O-C-N 123.239 0.337 . . . . 0.0 110.987 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.739 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -167.05 -156.72 0.22 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.147 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.46 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -44.96 110.64 0.43 Allowed Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 116.481 -0.327 . . . . 0.0 113.231 178.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER 54.05 -92.13 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.541 -0.063 . . . . 0.0 111.075 179.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.636 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.445 -0.715 0 CA-C-O 121.482 0.49 . . . . 0.0 113.905 178.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.6 mttp . . . . . 0 N--CA 1.447 -0.576 0 CA-C-O 121.365 0.602 . . . . 0.0 111.588 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 1.6 t -122.98 3.98 9.36 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.956 -178.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.676 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 0.6 OUTLIER -87.46 179.26 6.6 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.455 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.542 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -159.87 164.98 33.12 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 121.271 0.558 . . . . 0.0 111.929 -179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.616 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 37.6 t -86.82 80.47 8.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.136 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.542 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -74.6 -101.84 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.7 t -66.9 -19.05 65.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.44 0.638 . . . . 0.0 110.052 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.687 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -60.3 -46.5 89.66 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.415 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -14.46 0.19 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.538 -179.191 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.17 32.97 2.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.482 0.658 . . . . 0.0 110.287 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.56 16.11 8.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.983 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.15 -91.03 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.704 -0.76 . . . . 0.0 113.095 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.63 -60.13 1.91 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.627 0.727 . . . . 0.0 111.928 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.741 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 63.64 77.76 0.31 Allowed 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.383 -1.28 . . . . 0.0 108.611 -178.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.422 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 3.5 tpt180 -49.81 -22.99 1.63 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.267 -178.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.591 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 21.1 m-85 -137.16 48.22 2.08 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.6 125.66 1.3 Allowed Glycine 0 CA--C 1.519 0.297 0 CA-C-N 115.896 -0.593 . . . . 0.0 114.197 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.06 -23.54 0.24 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 111.944 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -117.37 5.58 12.58 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.291 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 26' ' ' TYR . 16.8 p -71.48 125.08 26.11 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.658 0.742 . . . . 0.0 112.555 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.417 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -119.51 -18.49 8.45 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.829 179.566 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.437 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.9 m-85 -159.55 -79.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.978 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.637 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -37.88 110.91 0.14 Allowed 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.741 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.47 -121.1 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.069 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.471 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -56.09 -102.77 0.01 OUTLIER Glycine 0 C--N 1.356 1.661 0 O-C-N 122.011 -0.431 . . . . 0.0 113.255 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.518 HD12 ' H ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -94.15 -54.92 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.037 0.446 . . . . 0.0 110.275 179.863 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.676 ' CA ' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.445 -0.75 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.653 178.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 1.0 OUTLIER . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 121.135 0.493 . . . . 0.0 111.941 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.2 t -119.36 -2.47 10.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.836 -178.73 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.749 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -80.35 -168.88 1.85 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.913 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.773 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -165.86 151.99 9.34 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.34 0.591 . . . . 0.0 112.339 -178.451 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.717 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 7.8 t -70.31 83.15 0.55 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.257 178.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.773 ' HG2' HD23 ' A' ' 14' ' ' LEU . 2.9 mmm-85 -77.29 -101.69 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 t -69.92 -23.32 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.771 0.796 . . . . 0.0 110.271 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.746 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -55.37 -44.57 76.18 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.685 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.9 t -46.59 -13.92 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.72 -179.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.58 30.95 1.63 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.493 0.663 . . . . 0.0 110.502 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.42 18.9 7.79 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.55 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.72 -90.65 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.932 -0.652 . . . . 0.0 113.639 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.423 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -113.12 -60.39 1.89 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.089 0.947 . . . . 0.0 112.219 -178.521 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.626 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.5 m 65.86 84.65 0.15 Allowed 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.854 -1.521 . . . . 0.0 108.116 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.644 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -50.39 -17.77 0.53 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.241 -178.04 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.714 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 20.1 m-85 -136.67 51.21 2.0 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.83 120.43 0.85 Allowed Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 114.299 -178.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.39 -17.59 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.0 0.52 . . . . 0.0 112.048 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.13 19.8 8.27 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.446 -179.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.714 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.3 p -81.57 122.61 27.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -177.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -115.44 -19.96 10.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.946 -1.479 . . . . 0.0 109.298 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.44 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 90.8 m-85 -156.99 -128.9 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.201 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.644 ' HB1' ' HG2' ' A' ' 25' ' ' ARG . . . 45.29 -157.49 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 121.138 0.494 . . . . 0.0 111.783 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.746 ' HA ' ' CE2' ' A' ' 18' ' ' TYR . 0.4 OUTLIER 78.71 -147.73 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.616 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.57 -161.26 0.51 Allowed Glycine 0 C--N 1.35 1.351 0 CA-C-O 121.237 0.354 . . . . 0.0 113.73 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.578 ' O ' HD21 ' A' ' 14' ' ' LEU . 5.8 tt -55.02 116.57 2.84 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.174 -0.513 . . . . 0.0 111.82 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.717 ' HA2' HD21 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.439 -1.151 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.336 177.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.44 -0.925 0 CA-C-O 121.272 0.558 . . . . 0.0 111.178 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.3 t -127.38 19.72 6.83 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.103 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.792 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.2 mt-10 -100.99 -169.7 1.74 Allowed 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -178.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.764 HD11 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -164.06 156.11 16.84 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.718 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.788 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 26.5 t -76.39 87.58 3.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.237 178.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.685 ' HG2' ' CD2' ' A' ' 14' ' ' LEU . 2.1 mmm-85 -74.9 -104.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.3 t -74.65 -17.09 60.74 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 121.76 0.79 . . . . 0.0 110.587 -179.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.6 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.6 m-85 -56.16 -42.3 76.8 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.12 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -25.6 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.934 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.46 ' O ' ' CB ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -66.5 -44.08 83.59 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.445 179.456 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.46 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 33.8 p 153.09 19.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.072 179.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.99 -95.84 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.694 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.484 ' HD3' ' C ' ' A' ' 24' ' ' CYS . 0.0 OUTLIER -115.56 -58.27 2.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.909 0.862 . . . . 0.0 112.608 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.753 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.2 m 68.92 82.64 0.17 Allowed 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 113.736 -1.575 . . . . 0.0 107.535 -176.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.477 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 5.5 tpp85 -47.02 -21.0 0.17 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.418 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.648 ' HB2' ' CA ' ' A' ' 30' ' ' CYS . 21.0 m-85 -140.38 54.35 1.62 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.753 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.93 -30.23 0.04 OUTLIER Glycine 0 N--CA 1.467 0.744 0 N-CA-C 115.924 1.13 . . . . 0.0 115.924 -177.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -114.17 -12.7 12.47 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.988 0.894 . . . . 0.0 111.283 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.438 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -131.61 31.08 4.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.525 -178.574 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.648 ' CA ' ' HB2' ' A' ' 26' ' ' TYR . 30.8 p -86.01 108.68 18.34 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -15.16 13.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.022 -1.444 . . . . 0.0 108.335 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.433 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.3 m-85 -157.28 -133.21 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.205 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.613 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 45.8 -156.34 0.03 OUTLIER 'General case' 0 N--CA 1.458 -0.071 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.788 ' CD2' ' HA ' ' A' ' 15' ' ' CYS . 0.3 OUTLIER 76.9 -165.36 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.882 179.573 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 36' ' ' LEU . . . -59.11 108.24 1.53 Allowed Glycine 0 C--N 1.34 0.778 0 CA-C-N 115.84 -0.618 . . . . 0.0 113.507 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.887 HD23 ' N ' ' A' ' 37' ' ' GLY . 3.1 tt 51.41 161.09 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.756 0.789 . . . . 0.0 111.557 178.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.887 ' N ' HD23 ' A' ' 36' ' ' LEU . . . . . . . . 0 N--CA 1.433 -1.544 0 CA-C-N 115.124 -0.944 . . . . 0.0 113.019 179.474 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 18.9 mttt . . . . . 0 N--CA 1.446 -0.63 0 CA-C-O 121.6 0.714 . . . . 0.0 111.344 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.4 t -126.75 1.99 6.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.901 -179.734 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.778 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -82.62 -169.11 2.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.529 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.75 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -162.2 155.23 20.21 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.811 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.738 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 36.0 t -77.72 85.27 4.03 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.75 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -71.48 -101.74 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.158 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 t -77.07 -23.12 51.97 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.001 0.905 . . . . 0.0 110.076 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.564 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -47.33 -51.39 19.53 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.277 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.78 -12.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.08 34.66 1.89 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.508 0.671 . . . . 0.0 110.347 179.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.32 16.65 9.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.359 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.2 -90.9 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.809 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.489 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -112.2 -65.33 1.19 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.585 0.707 . . . . 0.0 111.685 -179.102 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.742 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 64.82 81.8 0.2 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.024 -178.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.616 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 4.9 tpp85 -55.6 -13.61 1.69 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.049 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.725 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 15.5 m-30 -139.63 52.3 1.72 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.513 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.26 117.41 0.59 Allowed Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.114 -0.565 . . . . 0.0 114.333 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 78.95 -18.32 0.52 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -121.27 10.24 10.57 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.797 -179.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.562 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 16.5 p -74.66 130.94 40.43 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -177.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.468 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -132.21 -14.76 2.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.092 177.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.596 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 97.1 m-85 -158.89 -81.77 0.05 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.725 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -37.29 102.56 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 111.192 -177.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.742 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.48 -154.99 0.22 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.327 -179.062 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.551 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -62.69 97.63 0.19 Allowed Glycine 0 CA--C 1.496 -1.135 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 178.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 59.21 164.18 0.05 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.336 0.589 . . . . 0.0 110.129 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.778 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.43 -1.755 0 C-N-CA 120.17 -1.014 . . . . 0.0 113.187 179.692 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.436 ' O ' ' O ' ' A' ' 37' ' ' GLY . 3.4 t -132.92 24.85 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.365 -178.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.754 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -118.93 177.6 4.8 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -178.785 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.82 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -159.51 142.03 13.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.137 0.494 . . . . 0.0 112.205 -177.454 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.544 ' HA ' ' HD2' ' A' ' 34' ' ' HIS . 14.0 t -69.18 82.61 0.35 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.897 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.82 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -75.95 -99.62 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.704 0.288 . . . . 0.0 111.66 -178.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.4 t -72.97 -23.94 60.72 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.728 0.775 . . . . 0.0 109.974 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.557 ' CE1' ' CA ' ' A' ' 35' ' ' GLY . 3.0 m-85 -50.22 -47.15 55.01 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.923 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 p -49.12 -18.14 0.29 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.559 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.12 33.04 2.74 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.585 0.707 . . . . 0.0 110.62 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.99 17.28 8.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.292 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . 0.5 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.54 -19.8 73.18 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.725 -179.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 175.68 -69.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.716 0.769 . . . . 0.0 112.257 -179.259 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.735 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.7 m 64.26 81.48 0.21 Allowed 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.445 -1.252 . . . . 0.0 109.643 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.9 tpt180 -49.71 -19.46 0.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.112 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.568 ' O ' ' N ' ' A' ' 30' ' ' CYS . 24.2 m-85 -143.18 43.4 1.54 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.514 ' CA ' ' HB3' ' A' ' 24' ' ' CYS . . . -37.37 134.5 0.94 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.207 -0.52 . . . . 0.0 113.823 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 72.53 -24.67 0.19 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.996 0.427 . . . . 0.0 111.657 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.502 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -121.54 10.71 10.48 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.349 -179.001 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.568 ' N ' ' O ' ' A' ' 26' ' ' TYR . 25.6 p -79.8 118.67 21.8 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -110.34 -24.27 10.73 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.431 -1.258 . . . . 0.0 108.094 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.445 ' O ' ' O ' ' A' ' 33' ' ' ALA . 89.4 m-85 -161.14 -151.37 0.23 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.376 -1.284 . . . . 0.0 108.916 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 41.51 95.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 110.486 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.735 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.0 -143.22 0.06 Allowed 'General case' 0 CA--C 1.555 1.151 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.826 -177.88 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.557 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -63.94 118.95 14.38 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 122.171 -0.33 . . . . 0.0 113.248 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.638 HD23 ' N ' ' A' ' 37' ' ' GLY . 6.3 tt 46.55 -91.48 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.638 ' N ' HD23 ' A' ' 36' ' ' LEU . . . . . . . . 0 N--CA 1.447 -0.613 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.619 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mttp . . . . . 0 N--CA 1.454 -0.243 0 CA-C-O 121.246 0.546 . . . . 0.0 112.109 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 6.6 t -134.11 36.4 3.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.637 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.588 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -127.52 -175.2 3.39 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 -178.825 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.6 HD22 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -169.04 148.4 4.07 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-O 121.189 0.518 . . . . 0.0 112.181 -179.24 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.607 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 15.2 t -69.42 78.22 0.39 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.507 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.428 ' HG3' HD23 ' A' ' 14' ' ' LEU . 8.8 mtt-85 -68.77 -95.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -178.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.8 t -77.91 -22.1 50.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.839 0.828 . . . . 0.0 110.257 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.713 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.4 m-85 -50.7 -43.49 57.78 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.494 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.4 p -56.3 -38.0 70.66 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.517 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -57.01 -47.56 80.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.223 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 0.3 OUTLIER 156.24 30.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.518 179.684 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.79 -96.49 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.954 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.413 ' HB3' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -120.12 -52.0 2.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.016 0.912 . . . . 0.0 111.755 -179.017 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.736 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 62.79 76.47 0.36 Allowed 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.835 -1.529 . . . . 0.0 108.281 -177.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 5.8 tpt180 -46.93 -21.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.375 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.555 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 27.7 m-85 -139.8 42.96 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.582 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.99 126.63 1.52 Allowed Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.937 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 86.03 -35.48 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.007 0.523 . . . . 0.0 111.874 -179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 ttpt -114.81 9.27 16.25 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.052 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.555 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.2 p -72.5 116.12 12.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -176.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.415 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -109.24 -21.97 12.3 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.114 177.074 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.415 ' CG ' ' O ' ' A' ' 31' ' ' GLN . 86.2 m-85 -160.96 -157.49 0.52 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.553 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.606 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 41.94 102.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 178.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.736 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -165.28 -111.61 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.717 179.222 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.424 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -69.46 -119.71 0.03 OUTLIER Glycine 0 C--N 1.349 1.293 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -70.14 -73.6 0.16 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.943 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.588 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.444 -0.794 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.263 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HE3' ' HE2' ' A' ' 26' ' ' TYR . 9.3 mttm . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 121.267 0.556 . . . . 0.0 111.355 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 4.3 t -127.83 5.67 6.05 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.134 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.662 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 1.4 mt-10 -87.08 -176.47 5.72 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.637 HD13 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -160.9 149.4 16.26 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.379 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.625 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.2 t -72.49 86.32 1.16 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.71 178.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.598 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.11 -100.76 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -178.614 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 t -71.33 -23.19 61.89 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.702 0.763 . . . . 0.0 110.234 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.565 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.14 -50.12 49.78 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 114.595 -1.184 . . . . 0.0 112.181 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.47 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 88.8 p -56.01 -28.03 55.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.945 0.402 . . . . 0.0 112.058 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.543 ' O ' ' HB2' ' A' ' 21' ' ' SER . 2.2 tt0 -74.15 -39.81 63.03 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.91 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.543 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 35.0 t 159.36 10.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.536 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.48 -88.53 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.729 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.463 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -138.11 -57.81 0.66 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.144 0.973 . . . . 0.0 112.154 -178.123 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.738 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 74.22 77.37 0.12 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 113.217 -1.81 . . . . 0.0 108.381 -177.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 18.9 tpp180 -49.11 -16.92 0.17 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.725 -178.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.523 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 21.9 m-85 -142.95 48.96 1.48 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.61 126.66 1.79 Allowed Glycine 0 C--N 1.332 0.355 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.737 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.06 -18.44 0.44 Allowed 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 123.077 0.551 . . . . 0.0 112.202 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.79 17.88 6.79 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.57 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 23.7 p -85.01 115.61 22.93 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -177.114 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -112.09 -19.78 12.18 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.192 176.553 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.457 ' O ' ' O ' ' A' ' 33' ' ' ALA . 86.6 m-85 -160.75 -157.82 0.56 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.563 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.635 ' H ' ' HB2' ' A' ' 13' ' ' GLU . . . 42.34 98.25 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.143 0.177 . . . . 0.0 110.556 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.738 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.15 -142.23 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -178.241 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.515 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -56.87 -91.09 0.01 OUTLIER Glycine 0 C--N 1.35 1.329 0 N-CA-C 111.664 -0.575 . . . . 0.0 111.664 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.551 ' HB3' HD21 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -78.71 -152.53 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.409 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.662 ' CA ' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.439 -1.117 0 C-N-CA 119.615 -1.279 . . . . 0.0 114.12 179.251 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . 0.483 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.5 OUTLIER . . . . . 0 N--CA 1.448 -0.534 0 CA-C-O 120.724 0.297 . . . . 0.0 110.865 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 t -129.83 31.06 4.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.991 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.768 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.4 mt-10 -125.06 -167.52 1.69 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.218 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.768 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -166.25 155.88 11.79 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 112.061 -178.414 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.62 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.9 t -72.35 78.8 1.01 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.25 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.711 ' HG2' HD23 ' A' ' 14' ' ' LEU . 4.8 mmm180 -70.27 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.021 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.8 t -71.47 -20.65 62.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.668 0.746 . . . . 0.0 110.626 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.626 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -55.25 -47.05 75.98 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.798 -179.181 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -13.21 0.06 Allowed 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.282 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.41 31.49 1.97 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.625 0.726 . . . . 0.0 110.565 179.401 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.5 t 70.55 17.43 6.74 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.841 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -92.41 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.784 -0.722 . . . . 0.0 113.128 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HD3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -110.98 -61.78 1.64 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.982 0.896 . . . . 0.0 111.899 -178.999 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.74 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 63.71 81.39 0.21 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.046 -1.434 . . . . 0.0 108.684 -177.877 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.584 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -52.51 -19.87 2.55 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.285 -178.401 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.55 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.2 m-85 -137.36 49.55 2.0 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.149 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.504 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.82 119.98 0.8 Allowed Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.174 -0.467 . . . . 0.0 113.808 -179.188 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.14 -20.53 0.37 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 122.652 0.381 . . . . 0.0 111.627 -179.38 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.473 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -118.95 15.38 13.36 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.927 179.891 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.55 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 24.9 p -83.97 130.91 34.88 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.013 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -128.26 -18.38 4.09 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.056 -1.429 . . . . 0.0 110.201 178.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.493 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 95.3 m-85 -158.16 -74.48 0.09 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.644 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.685 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -41.43 105.12 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.796 -177.162 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.74 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.53 -133.33 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.732 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.431 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -68.64 -118.7 0.03 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.584 0.629 . . . . 0.0 111.736 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . 0.845 HD23 ' H ' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -70.89 -170.17 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.286 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.845 ' H ' HD23 ' A' ' 36' ' ' LEU . . . . . . . . 0 N--CA 1.441 -1.011 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.457 179.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt . . . . . 0 N--CA 1.447 -0.577 0 CA-C-O 121.46 0.648 . . . . 0.0 112.037 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -110.09 -22.32 11.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.469 -178.445 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.721 ' O ' ' HD2' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -79.4 -178.78 6.43 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.164 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.66 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -166.25 150.31 7.69 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.067 -178.582 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.625 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 9.2 t -67.74 77.48 0.2 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.66 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -67.02 -95.35 0.0 OUTLIER 'General case' 0 C--N 1.344 0.334 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 -178.896 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -80.39 -23.07 40.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 121.819 0.818 . . . . 0.0 110.054 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -48.42 -44.95 35.64 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.338 -1.301 . . . . 0.0 111.632 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.93 -11.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.71 32.77 1.37 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.536 0.684 . . . . 0.0 110.341 179.432 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m 65.45 28.65 11.56 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.664 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.06 -97.46 0.1 OUTLIER Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 116.048 -0.524 . . . . 0.0 113.062 -179.561 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.403 ' HB3' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -104.09 -58.59 1.86 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.719 0.771 . . . . 0.0 111.851 -179.155 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.708 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 58.04 81.04 0.16 Allowed 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.177 -177.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 6.6 tpm_? -51.64 -18.49 1.19 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.148 -178.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.687 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 25.9 m-85 -139.71 44.92 1.93 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.487 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.424 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.91 128.88 1.54 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.804 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.37 -24.49 0.22 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.051 -179.6 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 27' ' ' GLY . 5.1 ttpt -121.45 15.97 11.27 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.771 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.2 p -87.16 114.37 23.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -176.475 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.427 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -110.14 -19.12 13.15 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.769 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.721 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 86.5 m-85 -160.66 -160.99 0.8 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.896 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.687 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 46.58 98.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.73 178.754 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.708 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.21 -111.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.81 179.369 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.424 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -73.45 -127.37 0.12 Allowed Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 -179.62 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -60.44 -74.68 0.07 Allowed 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.219 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.657 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.451 -0.341 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.842 178.845 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.447 -0.59 0 CA-C-O 121.281 0.563 . . . . 0.0 111.701 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -119.12 -8.86 10.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.635 -178.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.855 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -81.95 -174.87 5.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.177 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.855 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -167.98 154.86 7.93 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 121.043 0.449 . . . . 0.0 111.506 -178.825 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' CYS . . . . . 0.621 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.8 t -72.47 83.31 1.09 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.226 179.541 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.848 ' HG3' HD23 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.86 -101.09 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -178.345 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -70.89 -20.35 62.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.783 0.801 . . . . 0.0 109.862 179.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.708 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -55.53 -48.02 75.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.659 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.6 t -45.88 -27.85 0.97 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.242 -178.897 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.595 ' O ' ' CB ' ' A' ' 21' ' ' SER . 0.7 OUTLIER -76.3 -31.89 58.45 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.067 -179.802 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.595 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 10.7 t 138.31 2.43 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.998 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.78 -38.5 10.06 Favored Glycine 0 C--N 1.332 0.311 0 N-CA-C 114.726 0.651 . . . . 0.0 114.726 -178.899 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.47 -62.35 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.703 0.763 . . . . 0.0 112.611 -178.396 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.702 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 65.64 80.88 0.22 Allowed 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.133 -1.394 . . . . 0.0 109.096 -177.72 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 1.3 tpm_? -50.25 -21.23 1.28 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.733 -179.319 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' TYR . . . . . 0.601 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 24.9 m-85 -140.62 55.07 1.59 Allowed 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.285 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLY . . . . . 0.669 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.64 -35.39 0.12 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 115.61 1.004 . . . . 0.0 115.61 -177.224 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.69 -18.48 13.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 118.167 0.983 . . . . 0.0 112.085 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.22 28.52 6.02 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.952 -178.162 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' CYS . . . . . 0.593 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 31.8 p -87.24 116.85 25.6 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -177.549 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.488 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -120.42 -14.02 8.76 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.945 178.585 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.645 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.9 m-85 -158.33 -85.88 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -178.959 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.594 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -34.9 109.55 0.08 Allowed 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -177.84 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.708 ' CG ' ' CD2' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -162.95 -112.06 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.287 178.415 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.479 ' HA2' ' CE1' ' A' ' 18' ' ' TYR . . . -58.41 -100.15 0.01 OUTLIER Glycine 0 C--N 1.348 1.226 0 N-CA-C 112.728 -0.149 . . . . 0.0 112.728 -179.237 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -116.3 -42.13 3.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.838 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.659 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . . . . . . 0 N--CA 1.45 -0.4 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.847 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.501 0 CA-C-O 120.782 0.325 . . . . 0.0 111.336 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.521 HG22 ' H ' ' A' ' 6' ' ' THR . 0.2 OUTLIER 57.38 -168.86 0.11 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.707 -179.939 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.521 ' H ' HG22 ' A' ' 5' ' ' THR . 59.8 p -56.29 143.83 32.56 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.797 0.332 . . . . 0.0 110.964 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -104.21 46.54 0.91 Allowed 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.791 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -177.18 -71.21 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.513 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.444 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 2.8 tpp85 61.7 151.47 0.03 OUTLIER 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.254 0.55 . . . . 0.0 111.076 179.602 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.474 ' CB ' ' CE1' ' A' ' 32' ' ' PHE . 3.9 m-85 -63.95 -162.84 0.01 OUTLIER 'General case' 0 N--CA 1.445 -0.719 0 CA-C-N 115.45 -0.795 . . . . 0.0 111.058 -179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.487 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -67.97 -166.2 0.06 Allowed 'General case' 0 N--CA 1.444 -0.735 0 CA-C-O 121.302 0.572 . . . . 0.0 111.266 -178.466 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.632 ' O ' HD12 ' A' ' 39' ' ' LEU . 3.0 t -119.87 1.0 10.96 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.381 -0.827 . . . . 0.0 112.191 -179.242 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.564 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -81.57 -173.74 4.57 Favored 'General case' 0 N--CA 1.444 -0.762 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 -178.384 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.806 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -161.12 147.92 14.94 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.922 0.391 . . . . 0.0 111.857 -179.362 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.638 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 18.8 t -72.34 85.9 1.11 Allowed 'General case' 0 CA--C 1.533 0.326 0 N-CA-C 109.188 -0.671 . . . . 0.0 109.188 179.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.806 ' HG3' HD23 ' A' ' 14' ' ' LEU . 1.1 mtp85 -78.07 -101.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -178.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -71.66 -21.48 61.81 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-O 121.737 0.78 . . . . 0.0 110.047 179.931 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.592 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -52.99 -48.07 67.76 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-N 114.493 -1.231 . . . . 0.0 112.032 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -50.12 -12.8 0.09 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.843 -179.19 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -97.39 32.96 2.1 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.473 0.654 . . . . 0.0 110.6 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER 70.02 15.11 7.78 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.848 -1.069 . . . . 0.0 111.689 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.0 -88.62 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.666 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.954 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -114.93 -64.45 1.31 Allowed 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.843 0.83 . . . . 0.0 112.153 -178.725 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.17 83.97 0.16 Allowed 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.152 -1.386 . . . . 0.0 108.711 -177.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.589 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 16.2 tpt85 -55.36 -14.1 1.72 Allowed 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 115.461 -0.79 . . . . 0.0 112.439 -178.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.699 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.7 m-85 -139.2 51.91 1.77 Allowed 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 178.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.49 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.4 118.81 0.76 Allowed Glycine 0 CA--C 1.52 0.401 0 C-N-CA 121.179 -0.534 . . . . 0.0 113.943 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.49 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.7 -14.97 0.73 Allowed 'General case' 0 N--CA 1.464 0.237 0 C-N-CA 122.736 0.414 . . . . 0.0 111.967 -179.714 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.474 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -124.94 17.09 8.57 Favored 'General case' 0 N--CA 1.437 -1.099 0 CA-C-N 116.02 -0.537 . . . . 0.0 111.273 -179.573 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.651 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 27.3 p -84.3 132.59 34.6 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -177.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.418 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -131.17 -17.36 3.05 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-N 113.65 -1.613 . . . . 0.0 110.38 178.827 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.487 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 82.8 m-85 -157.75 -85.79 0.04 OUTLIER 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.699 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -33.26 105.57 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.874 -177.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -161.99 -139.67 0.05 Allowed 'General case' 0 CA--C 1.557 1.228 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.025 -179.325 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.466 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -50.68 -113.53 0.01 OUTLIER Glycine 0 C--N 1.348 1.218 0 CA-C-N 118.118 0.417 . . . . 0.0 114.015 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.401 HD23 ' HG3' ' A' ' 38' ' ' GLU . 0.3 OUTLIER -63.14 -75.19 0.08 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.96 0.409 . . . . 0.0 111.436 -179.323 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.564 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 49.77 79.75 0.07 OUTLIER Glycine 0 N--CA 1.447 -0.582 0 CA-C-N 115.848 -0.614 . . . . 0.0 113.864 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.401 ' HG3' HD23 ' A' ' 36' ' ' LEU . 4.7 mt-10 -134.37 39.39 3.07 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.122 0.486 . . . . 0.0 109.69 178.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.632 HD12 ' O ' ' A' ' 12' ' ' THR . 11.1 mt -54.35 -46.38 72.93 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 115.723 -0.671 . . . . 0.0 111.582 -178.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.629 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -101.01 37.52 1.73 Allowed 'General case' 0 C--N 1.314 -0.94 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.759 179.944 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.526 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 24.2 mm-40 -152.03 12.86 0.59 Allowed 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.551 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.412 ' HB2' ' O ' ' A' ' 41' ' ' GLN . . . 178.74 -22.45 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.33 -0.395 . . . . 0.0 112.007 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.519 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . 0.5 OUTLIER . . . . . 0 C--O 1.25 1.122 0 CA-C-O 118.171 -0.919 . . . . 0.0 110.941 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.4 ttp . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.956 0.408 . . . . 0.0 111.288 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 46.3 p -135.58 -52.11 0.75 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.522 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.508 ' OG1' ' HB2' ' A' ' 9' ' ' ARG . 10.2 t -66.87 167.59 11.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.283 -179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -163.28 -40.75 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.918 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.0 m -86.21 -16.66 37.04 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.556 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.508 ' HB2' ' OG1' ' A' ' 6' ' ' THR . 0.0 OUTLIER -68.11 -175.43 0.59 Allowed 'General case' 0 C--N 1.332 -0.153 0 CA-C-O 120.677 0.275 . . . . 0.0 110.489 179.48 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.67 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 5.1 m-85 -76.99 -165.33 0.54 Allowed 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.895 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.465 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -71.21 -167.53 0.23 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.956 0.407 . . . . 0.0 110.965 -179.015 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.652 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 2.9 t -127.84 2.61 6.01 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.805 -0.634 . . . . 0.0 112.208 -179.413 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.664 ' CG ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -86.67 -174.03 4.78 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 112.488 0.551 . . . . 0.0 112.488 -178.454 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.795 HD12 HD11 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -169.01 156.51 7.32 Favored 'General case' 0 CA--C 1.52 -0.204 0 CA-C-O 121.554 0.692 . . . . 0.0 112.571 -179.201 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.658 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 5.1 t -71.17 84.02 0.73 Allowed 'General case' 0 N--CA 1.447 -0.584 0 CA-C-N 114.965 -1.016 . . . . 0.0 109.692 178.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.523 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -70.04 -97.71 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 120.822 0.344 . . . . 0.0 111.504 -179.109 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.1 t -81.59 -19.82 41.12 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 122.055 0.931 . . . . 0.0 110.171 179.644 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.715 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -50.61 -51.12 51.61 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.388 -1.278 . . . . 0.0 112.567 -179.317 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -51.11 -32.29 22.16 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.864 0.69 . . . . 0.0 112.864 -177.897 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.458 ' O ' ' CB ' ' A' ' 21' ' ' SER . 3.7 tt0 -68.16 -40.89 82.21 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.113 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.458 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 0.4 OUTLIER 158.64 18.63 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.743 179.978 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.93 -90.76 0.03 OUTLIER Glycine 0 N--CA 1.444 -0.821 0 C-N-CA 121.386 -0.435 . . . . 0.0 113.735 -179.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 1.3 ttt180 -133.36 -57.15 0.9 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.123 0.963 . . . . 0.0 112.272 -177.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.72 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 72.46 79.85 0.15 Allowed 'General case' 0 C--N 1.309 -1.188 0 CA-C-N 113.369 -1.741 . . . . 0.0 108.531 -177.33 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.464 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 12.0 tpt180 -50.96 -16.91 0.49 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.441 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.522 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 18.1 m-85 -140.91 49.9 1.66 Allowed 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 178.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.423 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.83 126.02 1.42 Allowed Glycine 0 C--N 1.335 0.508 0 CA-C-N 116.144 -0.48 . . . . 0.0 114.212 -179.663 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 70.96 -14.35 0.45 Allowed 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.14 -0.53 . . . . 0.0 112.219 -179.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.423 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -127.85 17.58 6.78 Favored 'General case' 0 N--CA 1.439 -0.98 0 C-N-CA 122.688 0.395 . . . . 0.0 111.299 -179.542 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.49 ' N ' ' O ' ' A' ' 26' ' ' TYR . 26.6 p -87.37 107.28 18.46 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 114.436 1.273 . . . . 0.0 114.436 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.507 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -103.67 -16.86 15.35 Favored 'General case' 0 N--CA 1.441 -0.918 0 CA-C-N 114.661 -1.154 . . . . 0.0 108.046 176.283 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.67 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 97.6 m-85 -153.71 -138.79 0.08 Allowed 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.793 179.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.665 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 51.75 -158.94 0.11 Allowed 'General case' 0 N--CA 1.455 -0.21 0 O-C-N 122.334 -0.229 . . . . 0.0 111.093 179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.72 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.3 OUTLIER 83.59 -147.1 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.148 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 178.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.411 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -61.39 -132.42 0.01 OUTLIER Glycine 0 C--N 1.358 1.771 0 N-CA-C 114.262 0.465 . . . . 0.0 114.262 -178.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.904 HD23 ' H ' ' A' ' 38' ' ' GLU . 1.0 OUTLIER -37.22 -77.12 0.02 OUTLIER 'General case' 0 C--O 1.233 0.219 0 CA-C-N 114.656 -0.772 . . . . 0.0 111.502 -179.8 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.664 ' HA3' ' CG ' ' A' ' 13' ' ' GLU . . . 52.23 20.82 7.33 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 121.275 -0.488 . . . . 0.0 113.937 179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.904 ' H ' HD23 ' A' ' 36' ' ' LEU . 2.5 mt-10 -85.51 46.3 1.29 Allowed 'General case' 0 C--N 1.312 -1.048 0 O-C-N 122.588 -0.36 . . . . 0.0 111.364 179.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.795 HD11 HD12 ' A' ' 14' ' ' LEU . 20.7 mt -54.1 -56.02 22.09 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.584 0.706 . . . . 0.0 110.934 179.575 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.652 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -93.15 39.87 1.05 Allowed 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 114.5 -1.227 . . . . 0.0 111.031 -179.483 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.601 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 16.7 mt-30 -153.73 -58.14 0.12 Allowed 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 121.07 0.462 . . . . 0.0 110.362 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 56.69 -177.81 0.05 Allowed 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.774 -0.648 . . . . 0.0 111.24 -179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.248 0.987 0 CA-C-O 118.165 -0.922 . . . . 0.0 110.993 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 6.9 mtt . . . . . 0 N--CA 1.487 1.397 0 CA-C-O 120.747 0.308 . . . . 0.0 111.333 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 4.9 t -84.63 138.3 32.78 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.857 -179.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -108.93 -31.34 7.7 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.073 -0.512 . . . . 0.0 111.159 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.0 p 65.72 34.99 7.16 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.999 179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 5.5 m 60.14 71.37 0.58 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.869 0.366 . . . . 0.0 110.84 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.02 153.72 30.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.976 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.571 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.7 m-85 -73.72 -164.25 0.21 Allowed 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 115.844 -0.616 . . . . 0.0 110.411 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.416 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -69.67 -166.7 0.11 Allowed 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 121.06 0.457 . . . . 0.0 110.765 -179.126 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.63 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 6.1 t -121.67 -3.92 9.25 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.787 -0.642 . . . . 0.0 112.447 -179.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.804 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -79.91 -170.45 2.44 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 113.517 0.932 . . . . 0.0 113.517 -177.93 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.665 HD12 HD11 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -166.06 144.84 5.88 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-O 121.337 0.589 . . . . 0.0 111.899 -179.089 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.64 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -71.16 84.73 0.74 Allowed 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 115.493 -0.776 . . . . 0.0 109.537 179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.688 ' CD ' HD11 ' A' ' 36' ' ' LEU . 3.8 mtp180 -79.48 -100.06 0.03 OUTLIER 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 112.031 0.382 . . . . 0.0 112.031 -178.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.0 t -71.34 -18.91 62.36 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-O 121.548 0.689 . . . . 0.0 110.604 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.692 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.8 m-85 -53.55 -48.08 69.44 Favored 'General case' 0 N--CA 1.443 -0.808 0 CA-C-N 114.782 -1.099 . . . . 0.0 111.943 -179.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -46.52 -36.77 7.07 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-O 121.18 0.514 . . . . 0.0 111.747 -179.162 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.526 ' O ' ' CB ' ' A' ' 21' ' ' SER . 1.6 tt0 -67.73 -38.17 83.17 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 115.476 -0.783 . . . . 0.0 110.922 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.526 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 14.4 t 150.53 -0.72 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.718 179.516 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -43.25 -41.11 4.85 Favored Glycine 0 C--N 1.332 0.342 0 N-CA-C 114.846 0.698 . . . . 0.0 114.846 -179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 23' ' ' ARG . 0.2 OUTLIER -178.26 -60.27 0.01 OUTLIER 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -178.463 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 67.26 80.78 0.21 Allowed 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.191 -1.368 . . . . 0.0 108.661 -176.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.613 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 3.9 tpp180 -52.52 -18.72 1.84 Allowed 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.624 -0.716 . . . . 0.0 112.674 -178.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.91 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 23.6 m-85 -137.09 49.76 2.02 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.722 -0.844 . . . . 0.0 108.722 178.514 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.435 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.09 122.22 0.85 Allowed Glycine 0 CA--C 1.519 0.309 0 C-N-CA 121.199 -0.524 . . . . 0.0 114.08 -178.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 78.21 -25.81 0.19 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.643 0.777 . . . . 0.0 112.333 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -115.25 8.52 15.52 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.474 -179.477 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.701 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 21.8 p -72.09 131.48 42.9 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 113.443 0.905 . . . . 0.0 113.443 -177.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.422 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.7 OUTLIER -127.57 -17.73 4.53 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 114.041 -1.436 . . . . 0.0 110.299 179.202 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.571 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 91.0 m-85 -158.62 -84.38 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.91 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -33.26 107.12 0.04 OUTLIER 'General case' 0 C--O 1.221 -0.433 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -177.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.27 -116.16 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.142 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.589 178.534 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.442 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -55.04 -103.22 0.01 OUTLIER Glycine 0 C--N 1.354 1.582 0 O-C-N 122.43 -0.169 . . . . 0.0 113.401 -178.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.763 HD12 ' H ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -100.45 -58.09 1.98 Allowed 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 179.489 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.804 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 50.32 86.02 0.02 OUTLIER Glycine 0 N--CA 1.442 -0.962 0 CA-C-N 115.377 -0.829 . . . . 0.0 113.749 178.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -128.2 46.85 2.51 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.126 -0.537 . . . . 0.0 110.552 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.665 HD11 HD12 ' A' ' 14' ' ' LEU . 11.3 mt -59.84 -30.22 68.81 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.731 -0.668 . . . . 0.0 111.667 -179.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.63 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -127.13 35.19 4.61 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.503 -179.629 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.599 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 1.9 mm-40 -151.09 72.48 1.06 Allowed 'General case' 0 N--CA 1.447 -0.58 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.618 179.224 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -51.05 178.57 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.344 179.808 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 C--O 1.25 1.08 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.746 179.939 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 27.6 ttm . . . . . 0 N--CA 1.485 1.299 0 CA-C-O 120.747 0.308 . . . . 0.0 111.265 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -146.66 -78.96 0.16 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.89 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -76.84 148.98 36.2 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.356 -0.383 . . . . 0.0 110.862 179.833 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.8 m -111.2 -37.38 5.33 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.264 -0.425 . . . . 0.0 111.023 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -161.58 93.31 0.92 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.813 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.14 -173.08 4.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.163 0.506 . . . . 0.0 111.019 179.792 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.507 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 3.6 m-85 -78.22 -161.82 0.3 Allowed 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.628 -0.715 . . . . 0.0 111.125 -179.737 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -62.68 -161.78 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.628 -178.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.55 41.12 3.49 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.853 -0.612 . . . . 0.0 112.125 -178.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.793 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.2 mt-10 -132.2 -168.36 2.03 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 112.22 0.452 . . . . 0.0 112.22 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.793 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -164.21 142.05 7.0 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.148 0.499 . . . . 0.0 111.597 -178.698 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.616 ' HA ' ' HD2' ' A' ' 34' ' ' HIS . 14.6 t -66.97 79.26 0.12 Allowed 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.842 -179.859 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.792 ' HG3' HD23 ' A' ' 14' ' ' LEU . 6.5 mtp85 -72.26 -97.96 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.626 -179.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -74.59 -23.47 58.74 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.87 0.843 . . . . 0.0 109.958 179.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.6 m-85 -49.91 -48.58 51.6 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.279 -1.328 . . . . 0.0 112.456 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -53.56 -37.59 63.04 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -178.618 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.476 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.5 tt0 -58.43 -44.62 89.21 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.53 -179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.476 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 1.9 p 154.12 28.86 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 115.709 -0.678 . . . . 0.0 110.678 179.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -72.24 -95.15 0.08 OUTLIER Glycine 0 N--CA 1.443 -0.838 0 C-N-CA 121.024 -0.608 . . . . 0.0 113.278 -179.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.41 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -121.02 -54.01 2.03 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 122.05 0.929 . . . . 0.0 111.925 -178.586 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.74 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.5 m 64.05 78.96 0.27 Allowed 'General case' 0 C--N 1.309 -1.19 0 CA-C-N 113.731 -1.577 . . . . 0.0 108.388 -177.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.548 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -47.39 -21.51 0.32 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 115.408 -0.814 . . . . 0.0 112.443 -178.217 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.741 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 25.9 m-85 -133.45 47.68 2.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 177.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.538 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.11 120.76 0.94 Allowed Glycine 0 C--N 1.332 0.338 0 CA-C-N 116.078 -0.51 . . . . 0.0 114.109 -179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.538 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 81.51 -23.23 0.23 Allowed 'General case' 0 N--CA 1.466 0.34 0 C-N-CA 123.098 0.559 . . . . 0.0 112.221 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.51 19.51 9.61 Favored 'General case' 0 N--CA 1.437 -1.083 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.245 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.648 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.7 p -84.43 127.48 34.04 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 114.848 1.425 . . . . 0.0 114.848 -176.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -123.16 -22.16 5.23 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 113.677 -1.601 . . . . 0.0 109.22 177.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.507 ' CD1' ' HB3' ' A' ' 10' ' ' TYR . 97.5 m-85 -160.54 -165.37 1.41 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.288 179.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.741 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 49.14 100.84 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.111 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.74 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -164.23 -109.81 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.092 179.893 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.423 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -75.66 -118.8 0.12 Allowed Glycine 0 C--N 1.349 1.252 0 CA-C-O 121.089 0.272 . . . . 0.0 113.024 -179.171 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.19 -78.69 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 120.757 0.313 . . . . 0.0 111.202 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 44.28 80.07 0.05 OUTLIER Glycine 0 C--N 1.333 0.389 0 CA-C-O 121.371 0.429 . . . . 0.0 113.972 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -135.73 41.2 2.73 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 115.064 -0.568 . . . . 0.0 109.992 178.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.408 HD12 HD12 ' A' ' 14' ' ' LEU . 10.3 mt -82.95 -23.51 33.4 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.788 179.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -121.58 55.02 1.11 Allowed 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 115.275 -0.875 . . . . 0.0 110.136 179.476 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.435 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 88.3 mt-30 -158.74 10.71 0.15 Allowed 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.404 -179.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.404 ' HB2' ' O ' ' A' ' 41' ' ' GLN . . . 178.22 -62.63 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.258 0 CA-C-O 120.84 0.352 . . . . 0.0 111.289 179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 17.5 m120 . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.015 -179.777 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.0 ttt . . . . . 0 N--CA 1.487 1.42 0 CA-C-O 120.725 0.298 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.7 p 67.34 18.13 10.2 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.362 -179.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 72.4 p -105.1 123.85 48.53 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.616 -0.266 . . . . 0.0 110.575 179.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 3.2 t -112.01 -63.72 1.39 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.849 0.357 . . . . 0.0 110.86 179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -110.98 -73.56 0.68 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.056 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.39 -167.62 0.18 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.021 0.439 . . . . 0.0 110.601 -179.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.477 ' HB3' ' CD2' ' A' ' 32' ' ' PHE . 4.1 m-85 -86.24 -163.03 0.82 Allowed 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.88 -179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.405 ' HD2' ' HB2' ' A' ' 33' ' ' ALA . 9.4 mttt -72.47 -164.96 0.17 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.198 0.523 . . . . 0.0 112.143 -178.369 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.453 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 2.6 t -129.01 37.32 4.09 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.932 -178.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.66 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.2 mt-10 -118.67 -174.37 2.67 Favored 'General case' 0 N--CA 1.447 -0.612 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.447 -179.1 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.87 HD12 HD11 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -157.09 150.75 24.38 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.872 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.611 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 34.6 t -74.92 88.09 2.32 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.373 178.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.687 ' HG3' HD23 ' A' ' 14' ' ' LEU . 16.5 mtp180 -77.13 -99.88 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 -178.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.2 t -73.06 -23.44 60.57 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-O 121.852 0.834 . . . . 0.0 110.061 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -49.54 -50.34 42.46 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.3 -1.318 . . . . 0.0 111.746 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 38.4 p -46.01 -15.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.268 -0.878 . . . . 0.0 113.353 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.45 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.1 OUTLIER -98.64 35.14 1.88 Allowed 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.538 0.685 . . . . 0.0 110.961 -179.512 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 4.2 m 68.6 17.4 8.98 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 114.519 -1.218 . . . . 0.0 112.072 178.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.3 -88.25 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.98 -0.629 . . . . 0.0 113.25 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -113.44 -62.18 1.63 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.874 0.845 . . . . 0.0 111.563 -178.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.699 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.8 m 61.38 80.12 0.23 Allowed 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 113.95 -1.477 . . . . 0.0 109.605 -178.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.1 OUTLIER -49.22 -21.47 0.8 Allowed 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.037 -179.451 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.684 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 19.6 m-85 -135.88 48.06 2.22 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.512 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.76 121.45 0.94 Allowed Glycine 0 CA--C 1.519 0.343 0 C-N-CA 121.266 -0.492 . . . . 0.0 114.156 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.512 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 80.74 -25.55 0.17 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.239 0.615 . . . . 0.0 112.438 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.4 ttpt -116.77 7.92 13.54 Favored 'General case' 0 N--CA 1.435 -1.196 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.546 -179.078 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.572 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.5 p -71.12 132.84 45.65 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 122.127 0.965 . . . . 0.0 113.557 -177.356 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -132.74 -17.3 2.52 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 113.522 -1.672 . . . . 0.0 110.211 179.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.477 ' CD2' ' HB3' ' A' ' 10' ' ' TYR . 89.6 m-85 -157.98 -80.69 0.06 Allowed 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -178.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.684 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -40.41 109.72 0.12 Allowed 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.855 -177.429 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -169.51 -145.5 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.117 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.546 -178.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.467 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -66.76 99.2 0.46 Allowed Glycine 0 C--N 1.345 1.06 0 O-C-N 122.042 -0.411 . . . . 0.0 112.3 178.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.747 HD23 ' N ' ' A' ' 37' ' ' GLY . 2.5 tt 54.9 169.13 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.672 0 CA-C-O 121.298 0.57 . . . . 0.0 110.246 179.795 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.747 ' N ' HD23 ' A' ' 36' ' ' LEU . . . -177.76 -101.08 0.14 Allowed Glycine 0 N--CA 1.431 -1.693 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.435 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.49 ' O ' ' N ' ' A' ' 41' ' ' GLN . 35.5 mt-10 50.74 23.32 1.35 Allowed 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 112.734 0.642 . . . . 0.0 112.734 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.87 HD11 HD12 ' A' ' 14' ' ' LEU . 6.2 mt -38.88 -43.58 0.96 Allowed 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 121.438 0.637 . . . . 0.0 111.035 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.453 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -99.05 35.56 1.87 Allowed 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.907 -1.042 . . . . 0.0 111.537 179.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' A' ' 38' ' ' GLU . 30.3 mt-30 -162.72 57.76 0.21 Allowed 'General case' 0 CA--C 1.53 0.176 0 CA-C-O 120.922 0.391 . . . . 0.0 110.79 179.58 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -46.21 141.57 3.32 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.91 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 . . . . . 0 C--O 1.248 0.978 0 CA-C-O 118.354 -0.832 . . . . 0.0 110.845 179.755 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 120.874 0.369 . . . . 0.0 111.364 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -154.57 50.16 0.61 Allowed 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.402 179.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.641 HG21 ' NH1' ' A' ' 9' ' ' ARG . 6.2 p 51.4 102.3 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.382 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.7 p -58.68 137.81 57.37 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.269 179.435 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 70.26 -64.4 0.36 Allowed 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.101 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.641 ' NH1' HG21 ' A' ' 6' ' ' THR . 0.0 OUTLIER -44.39 161.24 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.41 -179.783 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.509 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 4.1 m-85 -80.33 -163.35 0.55 Allowed 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.925 -0.579 . . . . 0.0 110.971 -179.649 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.434 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -70.84 -163.62 0.08 Allowed 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.281 0.563 . . . . 0.0 112.098 -178.247 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.591 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 5.6 t -128.12 36.69 4.27 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.679 -178.947 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -121.46 -170.09 1.97 Allowed 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.15 -179.329 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.835 HD23 ' HD3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -164.25 143.91 7.75 Favored 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -179.022 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.639 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 17.7 t -64.87 84.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.835 ' HD3' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.83 -100.88 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 111.986 0.365 . . . . 0.0 111.986 -178.675 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.431 ' H ' ' HB3' ' A' ' 16' ' ' ARG . 6.1 t -69.69 -25.99 64.15 Favored 'General case' 0 CA--C 1.517 -0.321 0 CA-C-O 121.935 0.874 . . . . 0.0 109.913 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.583 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.1 m-85 -50.17 -53.04 30.5 Favored 'General case' 0 N--CA 1.437 -1.097 0 CA-C-N 114.309 -1.314 . . . . 0.0 111.238 179.894 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -46.67 -12.94 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 115.194 -0.912 . . . . 0.0 113.166 -179.567 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -95.21 31.05 2.01 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.407 0.622 . . . . 0.0 110.667 179.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.9 m 69.4 21.18 7.02 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-N 114.892 -1.049 . . . . 0.0 111.024 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -70.66 -92.75 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.872 0 C-N-CA 121.168 -0.539 . . . . 0.0 113.059 -179.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -106.71 -64.18 1.2 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-O 121.917 0.865 . . . . 0.0 111.52 -179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.757 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.3 m 62.28 79.85 0.24 Allowed 'General case' 0 C--N 1.31 -1.115 0 CA-C-N 114.162 -1.381 . . . . 0.0 109.435 -178.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.623 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 27.2 tpt180 -47.96 -20.31 0.32 Allowed 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 115.629 -0.714 . . . . 0.0 112.12 -179.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.766 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 17.8 m-85 -140.83 57.59 1.56 Allowed 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 106.688 -1.597 . . . . 0.0 106.688 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.757 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -37.02 -35.08 0.12 Allowed Glycine 0 N--CA 1.465 0.601 0 N-CA-C 115.902 1.121 . . . . 0.0 115.902 -177.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.96 -16.66 13.06 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 118.321 1.06 . . . . 0.0 111.863 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.76 25.52 7.42 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 112.418 0.525 . . . . 0.0 112.418 -178.174 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.708 ' CA ' ' HB2' ' A' ' 26' ' ' TYR . 30.2 p -81.62 129.13 34.58 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -134.71 -15.4 2.09 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 113.589 -1.642 . . . . 0.0 110.253 178.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.538 ' O ' ' HB3' ' A' ' 13' ' ' GLU . 81.2 m-85 -157.66 -82.33 0.06 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 113.117 0.784 . . . . 0.0 113.117 -179.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.766 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -37.75 102.98 0.03 OUTLIER 'General case' 0 C--O 1.222 -0.358 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.522 -177.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.706 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.93 -138.51 0.04 OUTLIER 'General case' 0 CA--C 1.556 1.208 0 CA-C-N 115.819 -0.628 . . . . 0.0 109.451 -178.849 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.483 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -67.71 -163.95 2.4 Favored Glycine 0 C--N 1.349 1.264 0 CA-C-N 118.312 0.505 . . . . 0.0 112.283 178.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.603 ' O ' HD21 ' A' ' 14' ' ' LEU . 7.8 tt -44.95 117.01 1.2 Allowed 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.106 0.479 . . . . 0.0 110.321 179.036 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.432 ' O ' ' HG3' ' A' ' 13' ' ' GLU . . . -159.89 90.56 0.11 Allowed Glycine 0 N--CA 1.44 -1.036 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 -179.831 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.689 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 2.0 mm-40 -110.12 39.36 2.18 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.099 -0.55 . . . . 0.0 111.564 -179.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.422 HD11 HD12 ' A' ' 14' ' ' LEU . 5.3 mt -39.79 -41.14 1.07 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.168 0.508 . . . . 0.0 111.936 -179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.591 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -112.48 39.23 2.52 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.151 179.32 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.689 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 77.5 mt-30 -155.13 -16.99 0.11 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.775 179.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.87 113.81 2.48 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-O 120.908 0.385 . . . . 0.0 111.162 -179.665 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.807 -179.976 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 120.77 0.319 . . . . 0.0 111.34 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.33 83.63 2.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.78 179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 75.2 p -96.52 109.72 22.25 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.936 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.2 m -81.17 105.54 12.46 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.722 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m 73.92 -65.44 0.35 Allowed 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.634 -179.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 2.0 tpp180 62.97 159.18 0.08 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.664 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.565 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 5.3 m-85 -68.82 -163.31 0.04 OUTLIER 'General case' 0 N--CA 1.447 -0.579 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.908 -179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.424 ' HB2' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -60.47 -166.81 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 121.365 0.602 . . . . 0.0 112.103 -178.304 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.842 HG22 ' HB2' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -112.07 -26.66 8.74 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.968 -1.014 . . . . 0.0 112.795 -178.359 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.788 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.4 OUTLIER -79.49 -175.41 4.74 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 114.48 1.289 . . . . 0.0 114.48 -176.417 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.762 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -167.86 152.0 6.37 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.47 -178.492 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.661 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.5 t -70.31 84.07 0.56 Allowed 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 116.291 -0.413 . . . . 0.0 109.997 179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.761 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -77.35 -100.2 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.839 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.1 t -72.38 -23.21 61.08 Favored 'General case' 0 CA--C 1.522 -0.117 0 CA-C-O 121.736 0.779 . . . . 0.0 110.432 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.59 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -52.52 -45.34 66.24 Favored 'General case' 0 N--CA 1.441 -0.893 0 CA-C-N 114.574 -1.193 . . . . 0.0 111.876 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -49.77 -11.08 0.05 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.778 -0.647 . . . . 0.0 112.734 -179.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -96.73 33.73 1.8 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.583 0.706 . . . . 0.0 110.324 179.407 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.6 m 66.91 18.7 10.64 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 114.519 -1.219 . . . . 0.0 111.668 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -64.31 -92.72 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.72 0 C-N-CA 120.856 -0.688 . . . . 0.0 113.157 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.425 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -109.89 -64.12 1.29 Allowed 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.783 0.801 . . . . 0.0 112.179 -178.799 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.699 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 65.73 81.95 0.19 Allowed 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.561 -177.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.575 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -51.07 -19.1 0.98 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 115.177 -0.919 . . . . 0.0 112.188 -178.42 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.642 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 23.5 m-85 -141.23 46.44 1.73 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.507 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.26 127.91 1.68 Allowed Glycine 0 C--N 1.334 0.47 0 CA-C-N 116.009 -0.542 . . . . 0.0 113.915 -179.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.22 -23.88 0.24 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.01 0.433 . . . . 0.0 111.713 -179.342 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.5 OUTLIER -124.01 19.72 9.18 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.885 -179.838 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.515 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.0 p -89.1 113.37 24.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -176.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.42 ' C ' ' CD1' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -110.46 -19.35 12.97 Favored 'General case' 0 N--CA 1.439 -0.992 0 CA-C-N 114.512 -1.222 . . . . 0.0 108.112 176.413 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.641 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 91.8 m-85 -160.69 -153.69 0.33 Allowed 'General case' 0 N--CA 1.452 -0.344 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.376 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.642 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 40.91 95.91 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 122.052 0.141 . . . . 0.0 111.092 179.517 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.66 -136.19 0.03 OUTLIER 'General case' 0 CA--C 1.558 1.277 0 N-CA-C 109.917 -0.401 . . . . 0.0 109.917 -178.896 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.511 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -62.38 -104.05 0.01 OUTLIER Glycine 0 C--N 1.352 1.445 0 CA-C-N 118.672 0.669 . . . . 0.0 112.307 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -62.05 -130.21 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 178.876 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.788 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 100.09 -1.67 56.4 Favored Glycine 0 N--CA 1.437 -1.275 0 C-N-CA 120.299 -0.953 . . . . 0.0 114.726 177.625 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -87.51 32.55 0.71 Allowed 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.36 -0.536 . . . . 0.0 110.697 179.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.748 HD12 HD11 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -82.11 -20.16 38.65 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 120.925 0.393 . . . . 0.0 111.258 179.928 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.842 ' HB2' HG22 ' A' ' 12' ' ' THR . 0.0 OUTLIER -111.4 31.12 6.35 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.164 179.427 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.75 ' CG ' HG21 ' A' ' 12' ' ' THR . 2.9 mm-40 -151.2 -54.76 0.14 Allowed 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.005 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 60.22 114.95 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.181 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.14 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.82 -179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.492 ' O ' ' HB ' ' A' ' 5' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 120.652 0.263 . . . . 0.0 111.09 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.492 ' HB ' ' O ' ' A' ' 4' ' ' MET . 21.0 m 84.13 -39.96 0.07 Allowed 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.023 -179.591 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 10.6 p -145.15 -76.1 0.22 Allowed 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.298 179.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.1 m 60.57 82.68 0.16 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.089 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 m 55.72 33.21 20.91 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.662 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.443 ' HD2' HH12 ' A' ' 40' ' ' ARG . 0.0 OUTLIER -75.35 168.17 20.5 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.156 0.503 . . . . 0.0 110.647 -179.976 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.524 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.4 m-85 -75.35 -161.23 0.14 Allowed 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.679 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.529 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -67.24 -164.81 0.03 OUTLIER 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 121.167 0.508 . . . . 0.0 111.044 -178.478 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.936 HG21 ' HG3' ' A' ' 41' ' ' GLN . 1.1 t -117.79 -7.58 10.95 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.32 -178.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.82 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.9 OUTLIER -79.72 -175.51 4.89 Favored 'General case' 0 N--CA 1.442 -0.865 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -177.281 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.773 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -163.24 150.31 12.7 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.399 -178.771 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.604 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 8.6 t -71.96 81.66 0.93 Allowed 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.773 ' HG3' HD23 ' A' ' 14' ' ' LEU . 40.7 mtt-85 -75.69 -99.53 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 116.383 -0.372 . . . . 0.0 111.638 -179.087 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -74.75 -21.3 59.42 Favored 'General case' 0 C--N 1.333 -0.125 0 CA-C-O 121.556 0.693 . . . . 0.0 110.198 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.617 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -54.14 -45.48 71.98 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.72 -1.127 . . . . 0.0 111.653 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -47.73 -17.66 0.12 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.673 -179.021 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.67 35.71 2.53 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.645 0.736 . . . . 0.0 110.175 179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.8 m 69.0 12.39 8.6 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.415 179.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.568 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -63.01 -17.17 58.42 Favored Glycine 0 N--CA 1.445 -0.711 0 C-N-CA 120.644 -0.789 . . . . 0.0 113.935 -179.069 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.568 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 171.24 -68.68 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 113.299 0.851 . . . . 0.0 113.299 -179.783 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.729 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 4.0 m 64.3 83.83 0.16 Allowed 'General case' 0 C--N 1.313 -1.02 0 CA-C-N 114.921 -1.036 . . . . 0.0 109.358 -178.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.597 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 11.9 tpt180 -55.73 -13.75 1.88 Allowed 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 114.931 -1.031 . . . . 0.0 112.104 -179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.615 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.3 m-85 -139.74 52.6 1.7 Allowed 'General case' 0 N--CA 1.465 0.295 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 177.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.432 ' C ' ' H ' ' A' ' 29' ' ' LYS . . . -37.71 121.01 0.88 Allowed Glycine 0 CA--C 1.519 0.304 0 CA-C-N 116.051 -0.522 . . . . 0.0 113.694 -179.249 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . 71.82 -17.12 0.36 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.97 0.508 . . . . 0.0 112.055 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.466 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.1 OUTLIER -120.46 19.75 11.97 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.278 -179.777 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.569 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.1 p -87.0 131.75 33.99 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 114.254 1.205 . . . . 0.0 114.254 -177.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.411 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.9 OUTLIER -128.1 -20.91 3.7 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 113.366 -1.743 . . . . 0.0 109.72 178.61 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.544 ' CD2' ' O ' ' A' ' 13' ' ' GLU . 78.9 m-85 -155.71 -87.93 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.372 0 N-CA-C 112.822 0.675 . . . . 0.0 112.822 -179.779 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.615 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -28.88 102.79 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.729 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -160.39 -137.29 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.225 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.653 -179.711 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.558 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -46.11 -103.53 0.01 OUTLIER Glycine 0 C--N 1.344 1.013 0 O-C-N 121.861 -0.524 . . . . 0.0 113.621 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.41 ' O ' ' CG ' ' A' ' 13' ' ' GLU . 0.9 OUTLIER -89.03 -92.53 0.12 Allowed 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.523 -0.338 . . . . 0.0 110.435 -179.717 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.82 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 57.05 68.97 1.42 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 114.552 0.581 . . . . 0.0 114.552 178.048 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -128.24 31.62 5.02 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 177.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -77.12 -8.4 57.43 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.965 -0.561 . . . . 0.0 112.246 -178.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.468 ' HG3' ' HA ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -124.2 18.42 9.11 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.189 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.936 ' HG3' HG21 ' A' ' 12' ' ' THR . 14.1 mm-40 -146.22 -26.49 0.43 Allowed 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.9 -179.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -45.59 128.46 8.34 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 121.098 0.475 . . . . 0.0 111.723 -179.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.251 1.136 0 CA-C-O 118.357 -0.83 . . . . 0.0 110.707 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 40.1 mtt . . . . . 0 N--CA 1.488 1.428 0 CA-C-O 120.803 0.335 . . . . 0.0 111.223 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.7 t -76.12 115.95 16.33 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.603 179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.0 110.01 22.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.993 0.425 . . . . 0.0 110.973 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -69.22 132.88 47.19 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.665 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.4 m 62.42 31.05 17.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.17 179.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.98 169.62 16.54 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.875 0.369 . . . . 0.0 110.15 179.146 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.65 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 4.0 m-85 -79.33 -159.76 0.21 Allowed 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.924 -179.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.441 ' HB2' ' HB3' ' A' ' 32' ' ' PHE . 0.2 OUTLIER -73.91 -164.56 0.23 Allowed 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.192 0.52 . . . . 0.0 111.852 -177.132 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.602 ' OG1' ' HG3' ' A' ' 40' ' ' ARG . 3.9 t -125.09 41.35 3.53 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.745 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.568 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.3 OUTLIER -131.7 -168.0 1.96 Allowed 'General case' 0 N--CA 1.44 -0.968 0 N-CA-C 112.586 0.587 . . . . 0.0 112.586 -178.065 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.661 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -163.86 145.95 9.29 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-O 121.196 0.522 . . . . 0.0 111.787 -179.498 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.631 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 24.6 t -71.55 81.34 0.81 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.696 -0.684 . . . . 0.0 109.243 179.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.661 ' HG3' HD23 ' A' ' 14' ' ' LEU . 9.7 mtp180 -75.44 -97.96 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -178.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -73.98 -20.86 60.21 Favored 'General case' 0 N--CA 1.456 -0.138 0 CA-C-O 121.706 0.765 . . . . 0.0 110.493 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.631 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.0 m-85 -52.93 -44.38 66.98 Favored 'General case' 0 N--CA 1.443 -0.785 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.936 -179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 93.2 p -47.47 -18.21 0.12 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.746 -0.661 . . . . 0.0 112.381 -179.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -99.16 33.01 2.51 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.583 0.706 . . . . 0.0 110.443 179.477 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 41.1 t 67.0 17.15 10.48 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.534 -1.212 . . . . 0.0 111.875 179.505 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.54 -25.95 69.24 Favored Glycine 0 N--CA 1.447 -0.618 0 C-N-CA 120.847 -0.692 . . . . 0.0 113.887 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -179.08 -61.53 0.01 OUTLIER 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.747 0.784 . . . . 0.0 112.255 -179.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.704 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 2.8 m 57.51 84.5 0.1 Allowed 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.721 -177.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.5 tpp180 -53.41 -17.02 1.64 Allowed 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 115.289 -0.869 . . . . 0.0 111.849 -178.461 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.62 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 23.0 m-85 -136.52 47.55 2.18 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 177.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.55 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.72 119.96 0.77 Allowed Glycine 0 C--N 1.331 0.298 0 CA-C-N 115.898 -0.592 . . . . 0.0 114.115 -178.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 82.5 -27.78 0.12 Allowed 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.107 -0.547 . . . . 0.0 111.981 -179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -118.67 21.2 12.64 Favored 'General case' 0 N--CA 1.436 -1.157 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.242 -179.633 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.62 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 32.0 p -86.5 127.18 34.85 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 114.722 1.379 . . . . 0.0 114.722 -176.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.88 -20.62 5.35 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 113.968 -1.469 . . . . 0.0 109.676 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.65 ' CD1' ' HB3' ' A' ' 10' ' ' TYR . 97.1 m-85 -160.87 -160.89 0.78 Allowed 'General case' 0 N--CA 1.452 -0.331 0 CA-C-N 114.837 -1.074 . . . . 0.0 108.899 179.427 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 45.07 95.81 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.633 178.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.704 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -159.44 -116.04 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 116.25 -0.432 . . . . 0.0 109.876 179.418 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.467 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -64.64 -119.8 0.01 OUTLIER Glycine 0 C--N 1.35 1.328 0 N-CA-C 112.108 -0.397 . . . . 0.0 112.108 -179.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.496 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 6.9 tp -69.45 -74.8 0.12 Allowed 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 179.105 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.568 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 55.01 84.32 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.644 0 CA-C-N 115.891 -0.595 . . . . 0.0 114.084 178.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.496 ' HG3' ' HG ' ' A' ' 36' ' ' LEU . 4.3 mt-10 -139.85 38.3 1.98 Allowed 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 109.257 -0.646 . . . . 0.0 109.257 178.214 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.482 ' CD1' HD12 ' A' ' 14' ' ' LEU . 33.6 mt -62.09 -55.78 25.53 Favored 'General case' 0 CA--C 1.515 -0.398 0 CA-C-O 121.814 0.816 . . . . 0.0 110.476 -179.262 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.634 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -96.28 33.94 1.68 Allowed 'General case' 0 C--N 1.314 -0.952 0 CA-C-N 114.254 -1.339 . . . . 0.0 112.088 -179.796 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.634 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 12.2 mm-40 -153.77 15.7 0.5 Allowed 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 120.652 0.263 . . . . 0.0 110.852 179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -175.75 -36.75 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.208 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.47 ' HB2' ' HA ' ' A' ' 39' ' ' LEU . 1.1 m-80 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.852 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 12.3 mtp . . . . . 0 N--CA 1.491 1.601 0 CA-C-O 120.8 0.334 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 2.6 p -112.14 -15.04 13.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.245 -179.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.63 113.41 19.62 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.741 0.305 . . . . 0.0 110.716 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -110.6 13.8 22.51 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.431 -179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -144.58 -34.88 0.35 Allowed 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.876 0.369 . . . . 0.0 111.072 -179.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.422 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -63.93 163.57 11.84 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.145 0.498 . . . . 0.0 110.952 -179.843 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.491 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 3.2 m-85 -84.58 -161.33 0.55 Allowed 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.493 179.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 mttp -72.43 -165.53 0.2 Allowed 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.168 0.509 . . . . 0.0 112.051 -177.624 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.573 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 3.3 t -127.78 44.46 2.93 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.465 -179.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.646 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.1 mt-10 -126.92 177.54 6.55 Favored 'General case' 0 N--CA 1.438 -1.047 0 CA-C-N 115.343 -0.844 . . . . 0.0 111.201 -178.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.788 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -154.03 153.58 32.18 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 121.312 0.577 . . . . 0.0 112.151 -179.827 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.599 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 16.2 t -75.41 83.48 2.51 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.376 179.562 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.788 ' HG3' HD23 ' A' ' 14' ' ' LEU . 17.5 mtp180 -77.04 -100.19 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.498 0 CA-C-O 120.708 0.29 . . . . 0.0 111.768 -178.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -70.8 -21.27 62.49 Favored 'General case' 0 CA--C 1.522 -0.105 0 CA-C-O 121.49 0.662 . . . . 0.0 110.337 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.614 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.4 m-85 -54.22 -47.91 71.65 Favored 'General case' 0 N--CA 1.441 -0.907 0 CA-C-N 114.844 -1.071 . . . . 0.0 111.656 -179.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.2 -15.12 0.2 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.735 -0.666 . . . . 0.0 112.192 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.23 31.05 1.77 Allowed 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.532 0.682 . . . . 0.0 110.67 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.1 m 71.41 18.29 5.57 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.926 -1.034 . . . . 0.0 111.955 179.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.64 -91.15 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.929 -179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.455 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -115.42 -60.86 1.82 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 122.052 0.93 . . . . 0.0 112.198 -178.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.714 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 64.9 83.89 0.16 Allowed 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 114.016 -1.447 . . . . 0.0 108.104 -177.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.558 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 10.8 tpt180 -53.95 -16.85 2.08 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.698 -178.096 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.617 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.0 m-85 -138.16 51.25 1.88 Allowed 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 178.322 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.89 123.61 1.22 Allowed Glycine 0 CA--C 1.517 0.204 0 CA-C-N 115.91 -0.586 . . . . 0.0 113.492 -179.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 74.16 -19.52 0.35 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.172 0.589 . . . . 0.0 112.405 -179.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.68 16.49 10.29 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.16 -179.528 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.617 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.0 p -80.54 131.45 35.54 Favored 'General case' 0 CA--C 1.515 -0.389 0 CA-C-O 122.169 0.985 . . . . 0.0 113.559 -177.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.428 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -130.96 -16.96 3.17 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 113.711 -1.586 . . . . 0.0 110.252 179.347 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.491 ' CD1' ' HB3' ' A' ' 10' ' ' TYR . 88.1 m-85 -158.06 -85.0 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 113.12 0.785 . . . . 0.0 113.12 -178.527 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.701 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -34.43 109.01 0.07 Allowed 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 116.223 -0.444 . . . . 0.0 112.082 -177.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.714 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.52 -134.08 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.334 0 O-C-N 123.259 0.349 . . . . 0.0 110.388 -179.425 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.451 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -50.7 -111.05 0.01 OUTLIER Glycine 0 C--N 1.355 1.59 0 CA-C-N 118.58 0.627 . . . . 0.0 113.027 179.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.452 ' CD2' ' HG3' ' A' ' 38' ' ' GLU . 1.8 tp -75.38 -82.95 0.06 Allowed 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.646 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 68.62 95.87 0.04 OUTLIER Glycine 0 N--CA 1.442 -0.901 0 C-N-CA 121.036 -0.602 . . . . 0.0 113.362 178.536 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.605 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 4.7 mt-10 -139.86 32.41 2.0 Allowed 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.079 -0.56 . . . . 0.0 110.637 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.437 HD12 ' C ' ' A' ' 12' ' ' THR . 1.8 mt -42.41 -32.1 0.49 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.125 0.488 . . . . 0.0 111.71 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.573 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -120.06 41.96 3.06 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.401 179.166 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.605 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 12.6 mm-40 -158.78 37.36 0.22 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.985 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 41' ' ' GLN . . . 72.73 139.47 0.05 Allowed 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.377 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 26.1 p30 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.118 -0.944 . . . . 0.0 111.086 179.92 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.8 0.333 . . . . 0.0 111.144 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.4 p -122.58 -33.38 3.43 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.43 . . . . 0.0 111.333 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.77 66.54 0.8 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.91 0.385 . . . . 0.0 110.865 -179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.403 ' O ' ' HB2' ' A' ' 8' ' ' SER . 0.8 OUTLIER -70.81 171.06 11.24 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.171 -179.763 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.403 ' HB2' ' O ' ' A' ' 7' ' ' SER . 0.4 OUTLIER 68.97 -62.49 0.4 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.233 179.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 5.5 tpp180 -59.4 157.2 11.52 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.142 0.496 . . . . 0.0 110.763 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.479 ' CB ' ' CE1' ' A' ' 32' ' ' PHE . 3.9 m-85 -81.21 -162.71 0.52 Allowed 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.746 -179.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -72.91 -167.15 0.35 Allowed 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.515 -178.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.621 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 2.1 t -119.87 13.99 12.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.41 -0.814 . . . . 0.0 111.583 -179.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.605 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 2.9 mt-10 -96.53 -168.4 1.72 Allowed 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -178.297 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.631 HD22 ' N ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -168.99 153.54 5.67 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-O 121.441 0.639 . . . . 0.0 112.221 -179.22 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.627 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.1 t -73.28 82.0 1.36 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.329 179.333 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.629 ' HG3' HD23 ' A' ' 14' ' ' LEU . 4.2 mtp85 -72.67 -98.47 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.43 0 N-CA-C 111.968 0.358 . . . . 0.0 111.968 -178.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.3 t -75.4 -23.61 57.07 Favored 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 121.845 0.831 . . . . 0.0 110.086 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.594 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.1 -47.04 54.0 Favored 'General case' 0 N--CA 1.44 -0.968 0 CA-C-N 114.473 -1.239 . . . . 0.0 111.819 -179.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.62 -11.31 0.05 Allowed 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.681 -0.691 . . . . 0.0 112.834 -179.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -97.6 33.03 2.13 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.585 0.707 . . . . 0.0 110.529 179.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.05 16.51 8.67 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.703 179.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -91.31 0.02 OUTLIER Glycine 0 N--CA 1.446 -0.69 0 C-N-CA 120.838 -0.696 . . . . 0.0 112.98 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.503 ' NE ' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -111.05 -63.96 1.34 Allowed 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 121.957 0.884 . . . . 0.0 111.543 -179.112 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.702 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.3 m 64.33 83.01 0.17 Allowed 'General case' 0 C--N 1.311 -1.08 0 CA-C-N 113.98 -1.464 . . . . 0.0 109.382 -178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.503 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 2.2 tpt85 -50.92 -20.41 1.32 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.736 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.615 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 21.6 m-85 -142.39 55.92 1.44 Allowed 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 177.564 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.702 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.85 -32.75 0.07 OUTLIER Glycine 0 N--CA 1.464 0.523 0 N-CA-C 115.677 1.031 . . . . 0.0 115.677 -177.559 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -111.3 -17.04 13.25 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 118.337 1.068 . . . . 0.0 111.694 179.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.423 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.6 OUTLIER -126.08 25.9 6.63 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 116.065 -0.516 . . . . 0.0 112.226 -178.391 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.615 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 30.3 p -82.14 126.26 31.83 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 114.002 1.112 . . . . 0.0 114.002 -177.219 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -131.97 -14.91 3.05 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 113.57 -1.65 . . . . 0.0 110.12 179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.479 ' CE1' ' CB ' ' A' ' 10' ' ' TYR . 93.9 m-85 -158.83 -82.12 0.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 116.018 -0.537 . . . . 0.0 112.19 -179.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.698 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -35.33 108.53 0.07 Allowed 'General case' 0 C--O 1.222 -0.392 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.827 -178.184 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.699 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -168.74 -136.74 0.02 OUTLIER 'General case' 0 CA--C 1.56 1.33 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.05 -179.222 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.448 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -50.52 -112.08 0.01 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.365 0.53 . . . . 0.0 113.469 179.555 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.44 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 0.5 OUTLIER -76.68 -81.86 0.08 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.769 0.318 . . . . 0.0 110.271 -179.858 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.605 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 61.73 88.77 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.753 0 C-N-CA 121.307 -0.473 . . . . 0.0 113.677 178.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.534 ' HB3' ' O ' ' A' ' 41' ' ' GLN . 4.2 mt-10 -131.94 30.82 4.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.461 -0.37 . . . . 0.0 110.983 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.514 ' HG ' ' CD1' ' A' ' 14' ' ' LEU . 4.9 mt -39.1 -33.39 0.13 Allowed 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 -179.15 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.621 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.4 OUTLIER -123.57 33.98 5.2 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.432 179.716 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.565 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 22.6 mm100 -160.45 61.84 0.32 Allowed 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.443 179.413 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.78 -8.15 13.85 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.6 t30 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.169 -0.92 . . . . 0.0 110.77 179.767 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.0 ttt . . . . . 0 N--CA 1.489 1.483 0 CA-C-O 120.688 0.28 . . . . 0.0 111.069 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.09 142.19 28.11 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.76 0.314 . . . . 0.0 110.774 179.548 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 21.5 p -85.67 140.0 30.91 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.589 179.571 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 19.9 m -156.55 -53.68 0.08 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.26 -179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 12.2 p -93.98 46.55 1.18 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.883 -0.598 . . . . 0.0 110.545 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.97 179.14 0.19 Allowed 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.473 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.459 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.2 m-85 -75.24 -164.02 0.28 Allowed 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.583 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.419 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -67.14 -163.72 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.184 0.516 . . . . 0.0 111.558 -178.417 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.782 HG21 ' HG3' ' A' ' 41' ' ' GLN . 5.1 t -137.11 31.64 2.66 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.775 -178.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.683 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -123.25 -170.49 2.12 Favored 'General case' 0 N--CA 1.444 -0.752 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.686 -178.605 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.683 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -169.47 157.59 7.39 Favored 'General case' 0 CA--C 1.528 0.116 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -179.067 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.666 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 11.3 t -75.31 83.08 2.43 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.614 -0.721 . . . . 0.0 109.347 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.631 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -74.98 -99.58 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -178.476 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.0 t -75.71 -22.93 56.14 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-O 121.89 0.852 . . . . 0.0 109.991 179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.642 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.7 m-85 -51.67 -45.37 63.39 Favored 'General case' 0 N--CA 1.438 -1.05 0 CA-C-N 114.05 -1.432 . . . . 0.0 111.735 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 42.0 t -49.2 -16.9 0.19 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.645 -0.707 . . . . 0.0 112.292 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -100.91 34.39 2.5 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.601 0.715 . . . . 0.0 110.502 179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 67.04 15.58 10.15 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 114.739 -1.119 . . . . 0.0 111.081 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.581 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.19 -17.36 70.01 Favored Glycine 0 N--CA 1.443 -0.853 0 C-N-CA 121.128 -0.558 . . . . 0.0 114.082 -179.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.581 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 173.73 -71.64 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.605 0.717 . . . . 0.0 112.541 -178.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.714 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 65.32 80.39 0.23 Allowed 'General case' 0 C--N 1.315 -0.9 0 CA-C-N 114.733 -1.121 . . . . 0.0 109.653 -178.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.469 ' HA ' ' NE ' ' A' ' 23' ' ' ARG . 5.7 tpp85 -53.47 -16.94 1.65 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.378 -179.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.729 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 20.6 m-85 -142.55 47.61 1.57 Allowed 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.752 -0.833 . . . . 0.0 108.752 178.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.424 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -36.82 128.49 1.09 Allowed Glycine 0 C--N 1.333 0.367 0 C-N-CA 121.122 -0.561 . . . . 0.0 113.494 -179.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 73.38 -25.22 0.19 Allowed 'General case' 0 C--N 1.333 -0.137 0 N-CA-C 112.429 0.529 . . . . 0.0 112.429 -179.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.42 ' H ' ' C ' ' A' ' 27' ' ' GLY . 9.1 ttpt -115.41 5.28 14.51 Favored 'General case' 0 N--CA 1.438 -1.045 0 N-CA-C 111.756 0.28 . . . . 0.0 111.756 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.557 ' N ' ' O ' ' A' ' 26' ' ' TYR . 7.4 p -69.95 124.19 23.41 Favored 'General case' 0 N--CA 1.447 -0.617 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -177.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.462 ' O ' ' CD1' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -115.75 -22.34 9.19 Favored 'General case' 0 N--CA 1.437 -1.081 0 CA-C-N 114.398 -1.273 . . . . 0.0 109.408 178.895 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.469 ' HB3' ' H ' ' A' ' 13' ' ' GLU . 89.9 m-85 -159.97 -84.74 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 115.307 -0.86 . . . . 0.0 112.019 -179.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.729 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -27.03 104.64 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.398 0.679 . . . . 0.0 112.688 -178.457 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.714 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -163.56 -138.75 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.045 -179.704 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.555 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -44.15 -94.6 0.01 OUTLIER Glycine 0 C--N 1.346 1.131 0 CA-C-N 118.151 0.432 . . . . 0.0 113.636 -179.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.547 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 0.6 OUTLIER -104.13 -85.68 0.46 Allowed 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 115.115 -0.542 . . . . 0.0 110.901 -178.801 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.675 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 63.29 88.71 0.04 OUTLIER Glycine 0 N--CA 1.44 -1.073 0 C-N-CA 120.905 -0.664 . . . . 0.0 113.041 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.547 ' HG3' ' HG ' ' A' ' 36' ' ' LEU . 2.7 mt-10 -139.83 40.23 1.99 Allowed 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.984 -0.608 . . . . 0.0 109.647 178.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.471 HD12 HD12 ' A' ' 14' ' ' LEU . 7.4 mt -76.33 -15.28 60.01 Favored 'General case' 0 N--CA 1.467 0.41 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.683 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.62 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -132.68 47.05 2.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.77 -0.65 . . . . 0.0 111.38 -179.811 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.782 ' HG3' HG21 ' A' ' 12' ' ' THR . 1.6 mm-40 -154.51 -67.28 0.13 Allowed 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 120.983 0.42 . . . . 0.0 110.816 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 66.43 11.04 7.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.525 -179.689 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 2.2 m120 . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.139 -0.934 . . . . 0.0 110.832 179.83 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.545 ' O ' HG23 ' A' ' 5' ' ' THR . 1.5 mmt . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 120.601 0.238 . . . . 0.0 111.315 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.545 HG23 ' O ' ' A' ' 4' ' ' MET . 0.5 OUTLIER -171.06 -80.09 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.198 179.686 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 18.4 p -109.59 87.86 2.61 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.932 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 26.2 p -85.66 1.78 47.95 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.674 -179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.412 ' H ' ' H ' ' A' ' 9' ' ' ARG . 0.3 OUTLIER -169.04 -15.53 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.356 0 N-CA-C 111.719 0.266 . . . . 0.0 111.719 -179.756 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' H ' ' H ' ' A' ' 8' ' ' SER . 0.0 OUTLIER 69.83 -171.27 0.17 Allowed 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 120.782 0.325 . . . . 0.0 110.689 -179.606 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.559 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.6 m-85 -78.12 -158.09 0.12 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.704 -178.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.03 -164.94 0.49 Allowed 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.169 0.509 . . . . 0.0 110.741 -178.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.597 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 3.2 t -130.86 44.24 2.99 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.326 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.651 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -121.98 -174.53 2.9 Favored 'General case' 0 N--CA 1.435 -1.193 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.965 -179.065 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.808 HD23 ' HG3' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -158.32 132.18 7.81 Favored 'General case' 0 N--CA 1.465 0.308 0 N-CA-C 113.035 0.754 . . . . 0.0 113.035 -178.475 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.692 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 49.1 t -64.73 87.85 0.06 Allowed 'General case' 0 N--CA 1.446 -0.653 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 178.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.808 ' HG3' HD23 ' A' ' 14' ' ' LEU . 32.5 mtp180 -83.91 -103.73 0.05 OUTLIER 'General case' 0 C--N 1.347 0.464 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -178.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.9 t -66.06 -23.54 66.55 Favored 'General case' 0 CA--C 1.519 -0.22 0 CA-C-O 121.932 0.872 . . . . 0.0 109.98 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.54 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.4 m-85 -51.81 -50.23 61.21 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 114.068 -1.424 . . . . 0.0 112.285 -179.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.562 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 20.5 p -55.4 -35.43 65.32 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-N 115.85 -0.614 . . . . 0.0 111.772 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.477 ' O ' ' CB ' ' A' ' 21' ' ' SER . 2.7 tt0 -62.81 -41.23 99.21 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.976 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 13.2 p 152.94 13.52 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.203 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.12 -91.97 0.02 OUTLIER Glycine 0 N--CA 1.444 -0.775 0 C-N-CA 120.988 -0.625 . . . . 0.0 113.421 -179.01 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.556 ' HE ' ' HD3' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -120.43 -63.08 1.39 Allowed 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.971 0.891 . . . . 0.0 112.653 -178.046 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.739 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 70.64 79.67 0.17 Allowed 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.154 -1.385 . . . . 0.0 108.698 -177.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.578 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -54.4 -12.08 0.63 Allowed 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.499 -178.635 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.597 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 12.3 m-85 -142.84 51.07 1.42 Allowed 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.546 -0.909 . . . . 0.0 108.546 178.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.525 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.42 118.15 0.69 Allowed Glycine 0 CA--C 1.521 0.42 0 CA-C-N 116.003 -0.544 . . . . 0.0 113.921 -178.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.525 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 79.98 -23.17 0.25 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 9.6 ttpt -118.27 13.69 13.73 Favored 'General case' 0 N--CA 1.441 -0.906 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.526 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 14.3 p -77.73 130.77 37.17 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 113.915 1.08 . . . . 0.0 113.915 -176.757 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.03 -19.06 4.47 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 113.856 -1.52 . . . . 0.0 110.129 178.074 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.559 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 94.1 m-85 -158.79 -85.64 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 115.814 -0.63 . . . . 0.0 112.448 -179.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.597 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -28.42 101.18 0.02 OUTLIER 'General case' 0 C--N 1.35 0.604 0 O-C-N 123.239 0.337 . . . . 0.0 110.987 -178.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.739 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -167.05 -156.72 0.22 Allowed 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.147 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.46 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -44.96 110.64 0.43 Allowed Glycine 0 N--CA 1.447 -0.633 0 CA-C-N 116.481 -0.327 . . . . 0.0 113.231 178.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.526 ' CD2' ' HG3' ' A' ' 38' ' ' GLU . 0.9 OUTLIER 54.05 -92.13 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 121.541 -0.063 . . . . 0.0 111.075 179.107 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.636 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 66.15 94.61 0.03 OUTLIER Glycine 0 N--CA 1.445 -0.715 0 CA-C-O 121.482 0.49 . . . . 0.0 113.905 178.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.526 ' HG3' ' CD2' ' A' ' 36' ' ' LEU . 3.5 mt-10 -138.59 43.22 2.14 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.884 -0.658 . . . . 0.0 110.388 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.687 ' CG ' HD12 ' A' ' 14' ' ' LEU . 2.0 mt -53.98 -25.59 21.68 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 120.863 0.363 . . . . 0.0 111.897 -179.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.635 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -124.19 39.23 4.02 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.587 179.547 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.635 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 12.6 mm100 -159.18 46.01 0.28 Allowed 'General case' 0 N--CA 1.452 -0.375 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.792 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.98 -80.82 0.02 OUTLIER 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.722 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.184 -0.912 . . . . 0.0 111.099 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.693 0 CA-C-O 120.884 0.373 . . . . 0.0 111.588 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.8 t -156.92 74.72 0.81 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.861 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 20.8 p -78.27 123.51 27.03 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.65 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.4 p -105.17 69.8 0.87 Allowed 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.888 -179.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 84.5 p -173.54 -52.5 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.049 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER -63.91 164.01 11.02 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.11 0.481 . . . . 0.0 110.592 -179.991 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.609 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.8 m-85 -74.43 -163.78 0.22 Allowed 'General case' 0 N--CA 1.446 -0.639 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.26 -179.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 23.6 mttp -68.92 -167.61 0.11 Allowed 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.365 0.602 . . . . 0.0 111.588 -178.463 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.599 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 1.6 t -122.98 3.98 9.36 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.956 -178.833 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.676 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 0.6 OUTLIER -87.46 179.26 6.6 Favored 'General case' 0 N--CA 1.443 -0.808 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -177.455 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.601 HD12 HD11 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -159.87 164.98 33.12 Favored 'General case' 0 C--N 1.339 0.147 0 CA-C-O 121.271 0.558 . . . . 0.0 111.929 -179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.616 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 37.6 t -86.82 80.47 8.48 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.136 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.542 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -74.6 -101.84 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 112.686 0.625 . . . . 0.0 112.686 -177.878 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.7 t -66.9 -19.05 65.66 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.44 0.638 . . . . 0.0 110.052 -179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.687 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -60.3 -46.5 89.66 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 114.982 -1.008 . . . . 0.0 111.415 -179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.64 -14.46 0.19 Allowed 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.652 -0.704 . . . . 0.0 112.538 -179.191 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.17 32.97 2.04 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.482 0.658 . . . . 0.0 110.287 179.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER 69.56 16.11 8.14 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.983 179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -60.15 -91.03 0.02 OUTLIER Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 120.704 -0.76 . . . . 0.0 113.095 -179.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.63 -60.13 1.91 Allowed 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.627 0.727 . . . . 0.0 111.928 -178.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.741 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 63.64 77.76 0.31 Allowed 'General case' 0 C--N 1.31 -1.141 0 CA-C-N 114.383 -1.28 . . . . 0.0 108.611 -178.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.422 ' N ' ' CE1' ' A' ' 34' ' ' HIS . 3.5 tpt180 -49.81 -22.99 1.63 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.437 -0.801 . . . . 0.0 112.267 -178.064 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.591 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 21.1 m-85 -137.16 48.22 2.08 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.6 125.66 1.3 Allowed Glycine 0 CA--C 1.519 0.297 0 CA-C-N 115.896 -0.593 . . . . 0.0 114.197 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.06 -23.54 0.24 Allowed 'General case' 0 N--CA 1.462 0.126 0 C-N-CA 123.348 0.659 . . . . 0.0 111.944 -179.612 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 4.5 ttpt -117.37 5.58 12.58 Favored 'General case' 0 N--CA 1.441 -0.925 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.291 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.564 ' N ' ' O ' ' A' ' 26' ' ' TYR . 16.8 p -71.48 125.08 26.11 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.658 0.742 . . . . 0.0 112.555 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.417 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -119.51 -18.49 8.45 Favored 'General case' 0 N--CA 1.432 -1.372 0 CA-C-N 114.52 -1.218 . . . . 0.0 109.829 179.566 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.609 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 96.9 m-85 -159.55 -79.34 0.06 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.978 -179.388 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.637 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -37.88 110.91 0.14 Allowed 'General case' 0 C--O 1.224 -0.286 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -177.289 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.741 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.47 -121.1 0.01 OUTLIER 'General case' 0 CA--C 1.56 1.36 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.069 179.128 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.471 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -56.09 -102.77 0.01 OUTLIER Glycine 0 C--N 1.356 1.661 0 O-C-N 122.011 -0.431 . . . . 0.0 113.255 -178.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.518 HD12 ' H ' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -94.15 -54.92 3.38 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.037 0.446 . . . . 0.0 110.275 179.863 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.676 ' CA ' ' HA ' ' A' ' 13' ' ' GLU . . . 54.68 24.43 32.51 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.89 -0.672 . . . . 0.0 113.653 178.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 12.1 mt-10 -83.79 37.01 0.57 Allowed 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 111.81 0.3 . . . . 0.0 111.81 179.593 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.601 HD11 HD12 ' A' ' 14' ' ' LEU . 23.5 mt -43.88 -65.45 0.5 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-O 121.957 0.884 . . . . 0.0 111.077 179.236 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.662 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -85.82 36.2 0.65 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.582 -1.644 . . . . 0.0 111.727 -179.184 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.662 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 9.1 mm100 -158.33 70.53 0.54 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.75 0.31 . . . . 0.0 110.594 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -64.47 -7.96 11.89 Favored 'General case' 0 N--CA 1.451 -0.395 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 C--O 1.249 1.047 0 CA-C-O 118.263 -0.875 . . . . 0.0 111.053 179.815 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 120.795 0.331 . . . . 0.0 111.357 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 77.8 p -126.47 -69.74 0.75 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.637 179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 1.9 p -127.9 32.39 4.95 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.063 -0.517 . . . . 0.0 110.531 179.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 8' ' ' SER . 6.4 m 53.47 22.51 2.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.105 -0.498 . . . . 0.0 112.206 179.562 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.402 ' HB3' ' O ' ' A' ' 7' ' ' SER . 8.5 t 78.38 -16.76 0.63 Allowed 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.02 164.7 0.21 Allowed 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 121.406 0.622 . . . . 0.0 111.469 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.458 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.7 m-85 -84.59 -161.15 0.53 Allowed 'General case' 0 N--CA 1.448 -0.547 0 CA-C-N 114.917 -1.038 . . . . 0.0 110.833 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.44 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 1.0 OUTLIER -68.64 -167.93 0.11 Allowed 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.941 -178.426 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.677 ' HB ' ' HD2' ' A' ' 40' ' ' ARG . 6.2 t -119.36 -2.47 10.6 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.836 -178.73 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.749 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.6 OUTLIER -80.35 -168.88 1.85 Allowed 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 112.772 0.656 . . . . 0.0 112.772 -177.913 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.953 HD12 HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -165.86 151.99 9.34 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 121.34 0.591 . . . . 0.0 112.339 -178.451 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.717 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 7.8 t -70.31 83.15 0.55 Allowed 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 115.472 -0.785 . . . . 0.0 109.257 178.942 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.773 ' HG2' HD23 ' A' ' 14' ' ' LEU . 2.9 mmm-85 -77.29 -101.69 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.386 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -178.345 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 6.9 t -69.92 -23.32 63.2 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.771 0.796 . . . . 0.0 110.271 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.746 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.4 m-85 -55.37 -44.57 76.18 Favored 'General case' 0 N--CA 1.441 -0.888 0 CA-C-N 114.497 -1.229 . . . . 0.0 111.685 -179.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 2.9 t -46.59 -13.92 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.72 -179.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -93.58 30.95 1.63 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.493 0.663 . . . . 0.0 110.502 179.334 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 69.42 18.9 7.79 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.55 179.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.72 -90.65 0.03 OUTLIER Glycine 0 N--CA 1.448 -0.543 0 C-N-CA 120.932 -0.652 . . . . 0.0 113.639 -179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.423 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -113.12 -60.39 1.89 Allowed 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 122.089 0.947 . . . . 0.0 112.219 -178.521 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.626 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.5 m 65.86 84.65 0.15 Allowed 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 113.854 -1.521 . . . . 0.0 108.116 -177.246 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.644 ' HG2' ' HB1' ' A' ' 33' ' ' ALA . 0.0 OUTLIER -50.39 -17.77 0.53 Allowed 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.406 -0.815 . . . . 0.0 112.241 -178.04 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.714 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 20.1 m-85 -136.67 51.21 2.0 Allowed 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.471 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.83 120.43 0.85 Allowed Glycine 0 CA--C 1.519 0.291 0 CA-C-N 115.869 -0.605 . . . . 0.0 114.299 -178.843 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.39 -17.59 0.5 Allowed 'General case' 0 N--CA 1.463 0.192 0 C-N-CA 123.0 0.52 . . . . 0.0 112.048 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.13 19.8 8.27 Favored 'General case' 0 N--CA 1.437 -1.089 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.446 -179.369 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.714 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 28.3 p -81.57 122.61 27.79 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 113.639 0.977 . . . . 0.0 113.639 -177.536 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -115.44 -19.96 10.45 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 113.946 -1.479 . . . . 0.0 109.298 178.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.458 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 90.8 m-85 -156.99 -128.9 0.03 OUTLIER 'General case' 0 N--CA 1.45 -0.464 0 CA-C-N 114.696 -1.138 . . . . 0.0 109.201 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.644 ' HB1' ' HG2' ' A' ' 25' ' ' ARG . . . 45.29 -157.49 0.03 OUTLIER 'General case' 0 CA--C 1.528 0.098 0 CA-C-O 121.138 0.494 . . . . 0.0 111.783 179.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.746 ' HA ' ' CE2' ' A' ' 18' ' ' TYR . 0.4 OUTLIER 78.71 -147.73 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.902 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.616 -179.611 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -64.57 -161.26 0.51 Allowed Glycine 0 C--N 1.35 1.351 0 CA-C-O 121.237 0.354 . . . . 0.0 113.73 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.578 ' O ' HD21 ' A' ' 14' ' ' LEU . 5.8 tt -55.02 116.57 2.84 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 115.174 -0.513 . . . . 0.0 111.82 -179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.717 ' HA2' HD21 ' A' ' 14' ' ' LEU . . . -126.9 -106.63 1.44 Allowed Glycine 0 N--CA 1.439 -1.151 0 CA-C-N 115.133 -0.939 . . . . 0.0 111.336 177.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.9 mt-10 61.54 9.76 2.89 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.723 0.638 . . . . 0.0 112.723 178.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.953 HD12 HD12 ' A' ' 14' ' ' LEU . 27.5 mt -38.9 -63.59 0.51 Allowed 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.294 0.569 . . . . 0.0 112.216 -179.601 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.677 ' HD2' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -79.45 24.7 0.35 Allowed 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.095 -0.957 . . . . 0.0 112.179 -179.528 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.607 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 3.3 mt-30 -155.64 70.53 0.72 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 120.871 0.367 . . . . 0.0 110.443 179.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -40.26 143.19 0.32 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.79 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.821 -179.989 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.301 0 CA-C-O 120.762 0.315 . . . . 0.0 111.171 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 7.8 t -83.59 129.56 34.97 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.882 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 33.4 p -85.08 147.16 26.79 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.42 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -159.88 44.62 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.475 179.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.5 p -176.09 -63.79 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.602 -179.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.426 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 0.0 OUTLIER 67.3 157.39 0.12 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.216 0.531 . . . . 0.0 110.936 179.798 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.605 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.7 m-85 -80.64 -161.21 0.36 Allowed 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.336 -179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -73.21 -167.03 0.37 Allowed 'General case' 0 N--CA 1.44 -0.925 0 CA-C-O 121.272 0.558 . . . . 0.0 111.178 -179.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.844 HG21 ' HG3' ' A' ' 41' ' ' GLN . 3.3 t -127.38 19.72 6.83 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.344 -0.844 . . . . 0.0 111.103 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.792 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 1.2 mt-10 -100.99 -169.7 1.74 Allowed 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 111.795 0.295 . . . . 0.0 111.795 -178.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.9 HD12 ' CD1' ' A' ' 39' ' ' LEU . 0.0 OUTLIER -164.06 156.11 16.84 Favored 'General case' 0 N--CA 1.463 0.207 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -177.718 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.788 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 26.5 t -76.39 87.58 3.17 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.01 -0.996 . . . . 0.0 109.237 178.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.685 ' HG2' ' CD2' ' A' ' 14' ' ' LEU . 2.1 mmm-85 -74.9 -104.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 112.109 0.411 . . . . 0.0 112.109 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.3 t -74.65 -17.09 60.74 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-O 121.76 0.79 . . . . 0.0 110.587 -179.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.6 ' CE2' ' HA ' ' A' ' 34' ' ' HIS . 2.6 m-85 -56.16 -42.3 76.8 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.12 -179.453 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -59.08 -25.6 63.92 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.524 -0.762 . . . . 0.0 111.934 -178.431 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.46 ' O ' ' CB ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -66.5 -44.08 83.59 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.445 179.456 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.46 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 33.8 p 153.09 19.55 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.072 179.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -68.99 -95.84 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.74 0 C-N-CA 120.759 -0.734 . . . . 0.0 113.694 -179.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.484 ' HD3' ' C ' ' A' ' 24' ' ' CYS . 0.0 OUTLIER -115.56 -58.27 2.14 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.909 0.862 . . . . 0.0 112.608 -178.301 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.753 ' HB3' ' HA2' ' A' ' 27' ' ' GLY . 1.2 m 68.92 82.64 0.17 Allowed 'General case' 0 C--N 1.31 -1.127 0 CA-C-N 113.736 -1.575 . . . . 0.0 107.535 -176.702 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.64 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 5.5 tpp85 -47.02 -21.0 0.17 Allowed 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 115.388 -0.824 . . . . 0.0 112.418 -177.622 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.648 ' HB2' ' CA ' ' A' ' 30' ' ' CYS . 21.0 m-85 -140.38 54.35 1.62 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 176.903 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.753 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.93 -30.23 0.04 OUTLIER Glycine 0 N--CA 1.467 0.744 0 N-CA-C 115.924 1.13 . . . . 0.0 115.924 -177.167 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -114.17 -12.7 12.47 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 117.988 0.894 . . . . 0.0 111.283 179.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.438 ' C ' ' HB3' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -131.61 31.08 4.33 Favored 'General case' 0 N--CA 1.439 -1.006 0 CA-C-N 115.915 -0.584 . . . . 0.0 112.525 -178.574 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.648 ' CA ' ' HB2' ' A' ' 26' ' ' TYR . 30.8 p -86.01 108.68 18.34 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 -177.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.64 -15.16 13.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 114.022 -1.444 . . . . 0.0 108.335 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.605 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 96.3 m-85 -157.28 -133.21 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.574 -1.194 . . . . 0.0 109.205 -179.752 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.613 ' O ' ' HB2' ' A' ' 34' ' ' HIS . . . 45.8 -156.34 0.03 OUTLIER 'General case' 0 N--CA 1.458 -0.071 0 N-CA-C 110.221 -0.288 . . . . 0.0 110.221 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.788 ' CD2' ' HA ' ' A' ' 15' ' ' CYS . 0.3 OUTLIER 76.9 -165.36 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.971 -0.558 . . . . 0.0 111.882 179.573 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.501 ' O ' ' O ' ' A' ' 36' ' ' LEU . . . -59.11 108.24 1.53 Allowed Glycine 0 C--N 1.34 0.778 0 CA-C-N 115.84 -0.618 . . . . 0.0 113.507 179.148 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.887 HD23 ' N ' ' A' ' 37' ' ' GLY . 3.1 tt 51.41 161.09 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.756 0.789 . . . . 0.0 111.557 178.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.887 ' N ' HD23 ' A' ' 36' ' ' LEU . . . 162.6 97.58 0.12 Allowed Glycine 0 N--CA 1.433 -1.544 0 CA-C-N 115.124 -0.944 . . . . 0.0 113.019 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.513 ' HB3' ' H ' ' A' ' 42' ' ' ALA . 1.8 mt-10 -140.53 43.46 1.87 Allowed 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.851 -0.425 . . . . 0.0 109.851 179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.9 ' CD1' HD12 ' A' ' 14' ' ' LEU . 1.1 mt -70.17 -12.86 61.9 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.856 179.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.593 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -131.03 29.64 4.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.92 -0.582 . . . . 0.0 111.024 -179.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.844 ' HG3' HG21 ' A' ' 12' ' ' THR . 26.4 mm-40 -153.34 -58.61 0.13 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 121.159 0.504 . . . . 0.0 111.392 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.513 ' H ' ' HB3' ' A' ' 38' ' ' GLU . . . 60.47 113.2 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.914 -178.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 . . . . . 0 C--O 1.25 1.105 0 CA-C-O 118.291 -0.861 . . . . 0.0 110.826 -179.72 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.6 ppp? . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 111.796 0.295 . . . . 0.0 111.796 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.9 p -64.33 124.92 22.99 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.677 -0.238 . . . . 0.0 110.446 179.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.577 HG23 ' H ' ' A' ' 7' ' ' SER . 0.4 OUTLIER -136.05 -68.87 0.49 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 120.696 -0.402 . . . . 0.0 111.716 179.388 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.577 ' H ' HG23 ' A' ' 6' ' ' THR . 16.8 m 53.51 17.05 1.04 Allowed 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 111.596 0.221 . . . . 0.0 111.596 -179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -151.91 -49.06 0.11 Allowed 'General case' 0 C--N 1.335 -0.052 0 CA-C-O 120.877 0.37 . . . . 0.0 111.166 179.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 9' ' ' ARG . 0.1 OUTLIER -81.37 151.15 28.1 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.058 -179.824 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.594 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.9 m-85 -85.16 -163.16 0.79 Allowed 'General case' 0 N--CA 1.446 -0.628 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.475 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 18.9 mttt -67.64 -162.88 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.63 0 CA-C-O 121.6 0.714 . . . . 0.0 111.344 -179.105 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.504 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 3.4 t -126.75 1.99 6.73 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.901 -179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.778 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.8 OUTLIER -82.62 -169.11 2.3 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 111.748 0.277 . . . . 0.0 111.748 -179.529 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.75 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -162.2 155.23 20.21 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -178.811 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.738 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 36.0 t -77.72 85.27 4.03 Favored 'General case' 0 CA--C 1.533 0.313 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 179.272 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.75 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.3 OUTLIER -71.48 -101.74 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 113.124 0.787 . . . . 0.0 113.124 -178.158 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.1 t -77.07 -23.12 51.97 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-O 122.001 0.905 . . . . 0.0 110.076 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.564 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.0 m-85 -47.33 -51.39 19.53 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.183 -1.371 . . . . 0.0 111.277 179.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.78 -12.78 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 N-CA-C 113.067 0.766 . . . . 0.0 113.067 -179.691 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -98.08 34.66 1.89 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.508 0.671 . . . . 0.0 110.347 179.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 68.32 16.65 9.28 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.674 -1.148 . . . . 0.0 111.359 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -63.2 -90.9 0.03 OUTLIER Glycine 0 N--CA 1.446 -0.675 0 C-N-CA 120.724 -0.751 . . . . 0.0 112.809 -179.848 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.489 ' HD2' ' CE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -112.2 -65.33 1.19 Allowed 'General case' 0 C--N 1.318 -0.778 0 CA-C-O 121.585 0.707 . . . . 0.0 111.685 -179.102 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.742 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 64.82 81.8 0.2 Allowed 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.024 -178.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.616 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 4.9 tpp85 -55.6 -13.61 1.69 Allowed 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 115.112 -0.949 . . . . 0.0 112.049 -178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.725 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 15.5 m-30 -139.63 52.3 1.72 Allowed 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 178.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.513 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.26 117.41 0.59 Allowed Glycine 0 CA--C 1.52 0.361 0 C-N-CA 121.114 -0.565 . . . . 0.0 114.333 -178.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.513 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 78.95 -18.32 0.52 Allowed 'General case' 0 C--O 1.233 0.201 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 179.6 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -121.27 10.24 10.57 Favored 'General case' 0 N--CA 1.439 -0.987 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.797 -179.16 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.562 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 16.5 p -74.66 130.94 40.43 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 -177.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.468 ' HB3' ' CD1' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -132.21 -14.76 2.97 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.092 177.954 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.596 ' CB ' ' HB2' ' A' ' 11' ' ' LYS . 97.1 m-85 -158.89 -81.77 0.05 Allowed 'General case' 0 N--CA 1.447 -0.593 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.725 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -37.29 102.56 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 120.788 0.328 . . . . 0.0 111.192 -177.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.742 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.48 -154.99 0.22 Allowed 'General case' 0 CA--C 1.544 0.733 0 CA-C-N 115.371 -0.831 . . . . 0.0 109.327 -179.062 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.551 ' N ' ' CZ ' ' A' ' 18' ' ' TYR . . . -62.69 97.63 0.19 Allowed Glycine 0 CA--C 1.496 -1.135 0 N-CA-C 111.907 -0.477 . . . . 0.0 111.907 178.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 59.21 164.18 0.05 OUTLIER 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.336 0.589 . . . . 0.0 110.129 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.778 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 159.16 101.05 0.17 Allowed Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 120.17 -1.014 . . . . 0.0 113.187 179.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 2.9 mt-10 -136.18 45.89 2.33 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.199 -0.5 . . . . 0.0 110.271 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.723 HD11 HD12 ' A' ' 14' ' ' LEU . 1.5 mt -57.05 -20.48 24.95 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.54 -179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.547 ' HD2' ' O ' ' A' ' 40' ' ' ARG . 0.0 OUTLIER -133.63 42.81 2.94 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.36 179.666 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 42' ' ' ALA . 47.9 mt-30 -157.3 -49.29 0.07 Allowed 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 116.097 -0.502 . . . . 0.0 111.427 -179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.529 ' HB2' ' O ' ' A' ' 41' ' ' GLN . . . 171.59 84.39 0.0 OUTLIER 'General case' 0 C--O 1.231 0.081 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.147 -179.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.301 -0.856 . . . . 0.0 111.035 -179.755 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.8 mtt . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.766 0.317 . . . . 0.0 111.29 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.549 HG22 ' H ' ' A' ' 7' ' ' SER . 4.3 m -67.91 157.38 35.09 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.995 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.469 ' O ' ' HB3' ' A' ' 7' ' ' SER . 0.7 OUTLIER -121.37 -5.45 9.35 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 112.152 0.427 . . . . 0.0 112.152 -179.633 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.549 ' H ' HG22 ' A' ' 5' ' ' THR . 23.3 t 74.54 -67.59 0.25 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.72 0.295 . . . . 0.0 111.14 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 2.4 m -156.05 89.66 1.16 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.644 179.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.414 ' HA ' ' HD3' ' A' ' 9' ' ' ARG . 19.0 tpp180 -72.71 161.74 30.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.11 0.481 . . . . 0.0 111.314 -179.582 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.514 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.2 m-85 -72.82 -162.77 0.11 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.626 -0.715 . . . . 0.0 111.304 -179.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -162.83 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -178.022 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.899 HG21 ' HG3' ' A' ' 41' ' ' GLN . 3.4 t -132.92 24.85 4.29 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.309 -0.859 . . . . 0.0 112.365 -178.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.754 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -118.93 177.6 4.8 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -178.785 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.82 HD23 ' HG2' ' A' ' 16' ' ' ARG . 0.0 OUTLIER -159.51 142.03 13.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.137 0.494 . . . . 0.0 112.205 -177.454 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.544 ' HA ' ' HD2' ' A' ' 34' ' ' HIS . 14.0 t -69.18 82.61 0.35 Allowed 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 116.236 -0.438 . . . . 0.0 109.897 179.504 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.82 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -75.95 -99.62 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 120.704 0.288 . . . . 0.0 111.66 -178.96 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 11.4 t -72.97 -23.94 60.72 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.728 0.775 . . . . 0.0 109.974 179.529 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.557 ' CE1' ' CA ' ' A' ' 35' ' ' GLY . 3.0 m-85 -50.22 -47.15 55.01 Favored 'General case' 0 N--CA 1.443 -0.807 0 CA-C-N 114.542 -1.208 . . . . 0.0 111.923 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 49.5 p -49.12 -18.14 0.29 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.785 -0.643 . . . . 0.0 112.559 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.12 33.04 2.74 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-O 121.585 0.707 . . . . 0.0 110.62 -179.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER 68.99 17.28 8.63 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.292 179.659 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.5 ' O ' ' HB2' ' A' ' 23' ' ' ARG . . . -68.54 -19.8 73.18 Favored Glycine 0 N--CA 1.445 -0.739 0 C-N-CA 120.779 -0.724 . . . . 0.0 113.725 -179.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.5 ' HB2' ' O ' ' A' ' 22' ' ' GLY . 0.0 OUTLIER 175.68 -69.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.716 0.769 . . . . 0.0 112.257 -179.259 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.735 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.7 m 64.26 81.48 0.21 Allowed 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.445 -1.252 . . . . 0.0 109.643 -178.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 2.9 tpt180 -49.71 -19.46 0.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 115.382 -0.827 . . . . 0.0 112.112 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.568 ' O ' ' N ' ' A' ' 30' ' ' CYS . 24.2 m-85 -143.18 43.4 1.54 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 177.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.514 ' CA ' ' HB3' ' A' ' 24' ' ' CYS . . . -37.37 134.5 0.94 Allowed Glycine 0 C--N 1.333 0.371 0 C-N-CA 121.207 -0.52 . . . . 0.0 113.823 -178.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 72.53 -24.67 0.19 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-O 120.996 0.427 . . . . 0.0 111.657 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.502 ' H ' ' C ' ' A' ' 27' ' ' GLY . 0.0 OUTLIER -121.54 10.71 10.48 Favored 'General case' 0 N--CA 1.436 -1.138 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.349 -179.001 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.568 ' N ' ' O ' ' A' ' 26' ' ' TYR . 25.6 p -79.8 118.67 21.8 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 114.741 1.386 . . . . 0.0 114.741 -176.473 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -110.34 -24.27 10.73 Favored 'General case' 0 N--CA 1.442 -0.869 0 CA-C-N 114.431 -1.258 . . . . 0.0 108.094 176.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.514 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 89.4 m-85 -161.14 -151.37 0.23 Allowed 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 114.376 -1.284 . . . . 0.0 108.916 179.687 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.552 ' O ' ' HB3' ' A' ' 25' ' ' ARG . . . 41.51 95.07 0.01 OUTLIER 'General case' 0 C--O 1.224 -0.288 0 CA-C-O 120.599 0.238 . . . . 0.0 110.486 179.196 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.735 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.0 -143.22 0.06 Allowed 'General case' 0 CA--C 1.555 1.151 0 CA-C-N 116.179 -0.464 . . . . 0.0 109.826 -177.88 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.557 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -63.94 118.95 14.38 Favored Glycine 0 C--N 1.345 1.063 0 O-C-N 122.171 -0.33 . . . . 0.0 113.248 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.638 HD23 ' N ' ' A' ' 37' ' ' GLY . 6.3 tt 46.55 -91.48 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 111.706 0.261 . . . . 0.0 111.706 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.638 ' N ' HD23 ' A' ' 36' ' ' LEU . . . 52.16 77.71 0.13 Allowed Glycine 0 N--CA 1.447 -0.613 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.619 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -129.58 42.95 3.21 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.235 -0.482 . . . . 0.0 109.727 179.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.74 HD12 HD12 ' A' ' 14' ' ' LEU . 3.2 mt -76.08 -13.56 60.21 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-N 115.694 -0.685 . . . . 0.0 111.622 -179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.453 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -130.26 24.04 5.2 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.722 179.761 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.899 ' HG3' HG21 ' A' ' 12' ' ' THR . 6.4 mm-40 -145.98 -45.32 0.2 Allowed 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 116.308 -0.406 . . . . 0.0 111.126 179.766 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 62.97 165.37 0.12 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.185 -0.462 . . . . 0.0 110.712 -179.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.058 0 CA-C-O 118.156 -0.926 . . . . 0.0 110.934 -179.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.1 mtm . . . . . 0 N--CA 1.487 1.401 0 CA-C-O 120.663 0.268 . . . . 0.0 111.517 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 1.1 m -71.08 160.44 32.88 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.849 0.357 . . . . 0.0 110.738 -179.98 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.448 ' O ' ' HB2' ' A' ' 7' ' ' SER . 17.7 p -137.48 23.45 2.94 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.107 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.448 ' HB2' ' O ' ' A' ' 6' ' ' THR . 70.9 m 71.5 -83.29 0.03 OUTLIER 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.71 -179.583 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.3 p -161.76 34.88 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.723 0.297 . . . . 0.0 111.047 179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 3.4 tpp85 -84.18 158.46 21.31 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.076 0.465 . . . . 0.0 110.47 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.453 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.1 m-85 -71.56 -163.42 0.1 Allowed 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.405 -179.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mttp -61.79 -164.74 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.869 -0.605 . . . . 0.0 112.109 -178.112 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.558 ' OG1' ' HG3' ' A' ' 40' ' ' ARG . 6.6 t -134.11 36.4 3.24 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.637 -179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.588 ' HA ' ' HA3' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -127.52 -175.2 3.39 Favored 'General case' 0 N--CA 1.439 -1.008 0 N-CA-C 111.721 0.267 . . . . 0.0 111.721 -178.825 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.721 HD12 HD21 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -169.04 148.4 4.07 Favored 'General case' 0 C--N 1.334 -0.068 0 CA-C-O 121.189 0.518 . . . . 0.0 112.181 -179.24 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.607 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 15.2 t -69.42 78.22 0.39 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.469 -0.787 . . . . 0.0 109.507 179.818 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.428 ' HG3' HD23 ' A' ' 14' ' ' LEU . 8.8 mtt-85 -68.77 -95.63 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.784 0.29 . . . . 0.0 111.784 -178.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.8 t -77.91 -22.1 50.2 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.839 0.828 . . . . 0.0 110.257 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.713 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.4 m-85 -50.7 -43.49 57.78 Favored 'General case' 0 N--CA 1.44 -0.929 0 CA-C-N 114.21 -1.359 . . . . 0.0 112.494 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.4 p -56.3 -38.0 70.66 Favored 'General case' 0 CA--C 1.517 -0.289 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.517 ' O ' ' HB2' ' A' ' 21' ' ' SER . 0.2 OUTLIER -57.01 -47.56 80.56 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.223 179.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.517 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 0.3 OUTLIER 156.24 30.93 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.518 179.684 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -71.79 -96.49 0.07 OUTLIER Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.734 -0.746 . . . . 0.0 112.954 -179.475 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.413 ' HB3' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -120.12 -52.0 2.2 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 122.016 0.912 . . . . 0.0 111.755 -179.017 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.736 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 62.79 76.47 0.36 Allowed 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 113.835 -1.529 . . . . 0.0 108.281 -177.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.496 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 5.8 tpt180 -46.93 -21.94 0.27 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 115.365 -0.834 . . . . 0.0 112.375 -178.088 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.555 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 27.7 m-85 -139.8 42.96 1.97 Allowed 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.144 -0.687 . . . . 0.0 109.144 178.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.582 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.99 126.63 1.52 Allowed Glycine 0 C--N 1.331 0.292 0 CA-C-N 115.954 -0.566 . . . . 0.0 113.937 -179.133 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.582 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 86.03 -35.48 0.04 OUTLIER 'General case' 0 CA--C 1.518 -0.256 0 C-N-CA 123.007 0.523 . . . . 0.0 111.874 -179.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 7.6 ttpt -114.81 9.27 16.25 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.052 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.555 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 17.2 p -72.5 116.12 12.58 Favored 'General case' 0 N--CA 1.45 -0.456 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -176.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.415 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -109.24 -21.97 12.3 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.114 177.074 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.453 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 86.2 m-85 -160.96 -157.49 0.52 Allowed 'General case' 0 N--CA 1.449 -0.484 0 CA-C-N 114.393 -1.276 . . . . 0.0 109.553 -179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.606 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . 41.94 102.81 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 178.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.736 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -165.28 -111.61 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.717 179.222 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.424 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -69.46 -119.71 0.03 OUTLIER Glycine 0 C--N 1.349 1.293 0 N-CA-C 111.987 -0.445 . . . . 0.0 111.987 -179.707 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.462 ' HG ' ' HG3' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -70.14 -73.6 0.16 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 178.943 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.588 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 58.79 91.57 0.01 OUTLIER Glycine 0 N--CA 1.444 -0.794 0 CA-C-N 115.985 -0.552 . . . . 0.0 113.263 178.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.462 ' HG3' ' HG ' ' A' ' 36' ' ' LEU . 3.0 mt-10 -134.24 46.45 2.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.211 -0.495 . . . . 0.0 110.558 179.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.721 HD21 HD12 ' A' ' 14' ' ' LEU . 4.2 mt -55.92 -19.96 14.12 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 -179.649 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.558 ' HG3' ' OG1' ' A' ' 12' ' ' THR . 0.1 OUTLIER -141.35 24.56 2.1 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.187 179.874 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 8.7 mm-40 -144.14 11.92 1.57 Allowed 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.417 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.423 ' HB2' ' HB2' ' A' ' 38' ' ' GLU . . . -87.73 37.4 0.79 Allowed 'General case' 0 N--CA 1.45 -0.449 0 CA-C-O 120.764 0.316 . . . . 0.0 111.772 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 6.2 t30 . . . . . 0 C--O 1.25 1.09 0 CA-C-O 118.291 -0.861 . . . . 0.0 110.888 179.805 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.6 mtt . . . . . 0 N--CA 1.489 1.512 0 CA-C-O 120.896 0.379 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.49 HG22 HH22 ' A' ' 40' ' ' ARG . 2.9 m 73.25 -63.54 0.43 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.332 179.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 82.7 p -130.68 -52.96 1.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.953 -179.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 2.5 t 59.23 23.6 11.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.578 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -154.29 -65.22 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.741 0.305 . . . . 0.0 111.464 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.12 158.93 35.01 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.154 0.502 . . . . 0.0 110.759 -179.338 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.573 ' HB3' ' CE2' ' A' ' 32' ' ' PHE . 3.9 m-85 -74.95 -164.12 0.27 Allowed 'General case' 0 N--CA 1.449 -0.522 0 CA-C-N 115.375 -0.829 . . . . 0.0 111.179 -179.445 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.475 ' HE3' ' HE2' ' A' ' 26' ' ' TYR . 9.3 mttm -66.57 -165.85 0.03 OUTLIER 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.267 0.556 . . . . 0.0 111.355 -178.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.569 ' HB ' ' HG2' ' A' ' 40' ' ' ARG . 4.3 t -127.83 5.67 6.05 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.134 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.662 ' HA ' ' CA ' ' A' ' 37' ' ' GLY . 1.4 mt-10 -87.08 -176.47 5.72 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 -178.137 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.637 HD13 ' HA2' ' A' ' 37' ' ' GLY . 0.0 OUTLIER -160.9 149.4 16.26 Favored 'General case' 0 N--CA 1.471 0.578 0 N-CA-C 113.564 0.95 . . . . 0.0 113.564 -178.379 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.625 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.2 t -72.49 86.32 1.16 Allowed 'General case' 0 N--CA 1.453 -0.306 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.71 178.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.598 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -79.11 -100.76 0.03 OUTLIER 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -178.614 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.0 t -71.33 -23.19 61.89 Favored 'General case' 0 CA--C 1.52 -0.179 0 CA-C-O 121.702 0.763 . . . . 0.0 110.234 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.565 ' CD2' ' CD2' ' A' ' 34' ' ' HIS . 2.5 m-85 -50.14 -50.12 49.78 Favored 'General case' 0 N--CA 1.441 -0.905 0 CA-C-N 114.595 -1.184 . . . . 0.0 112.181 -179.743 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.47 ' HB3' ' SG ' ' A' ' 15' ' ' CYS . 88.8 p -56.01 -28.03 55.52 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.945 0.402 . . . . 0.0 112.058 -179.156 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.543 ' O ' ' HB2' ' A' ' 21' ' ' SER . 2.2 tt0 -74.15 -39.81 63.03 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.91 -179.787 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.543 ' HB2' ' O ' ' A' ' 20' ' ' GLU . 35.0 t 159.36 10.73 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.746 0 CA-C-N 115.583 -0.735 . . . . 0.0 111.536 179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -55.48 -88.53 0.01 OUTLIER Glycine 0 N--CA 1.447 -0.583 0 C-N-CA 121.115 -0.564 . . . . 0.0 113.729 -179.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.463 ' O ' ' HB2' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -138.11 -57.81 0.66 Allowed 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.144 0.973 . . . . 0.0 112.154 -178.123 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.738 ' HA ' ' NE2' ' A' ' 34' ' ' HIS . 1.3 m 74.22 77.37 0.12 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 113.217 -1.81 . . . . 0.0 108.381 -177.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.512 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 18.9 tpp180 -49.11 -16.92 0.17 Allowed 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.725 -178.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.523 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 21.9 m-85 -142.95 48.96 1.48 Allowed 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.444 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -38.61 126.66 1.79 Allowed Glycine 0 C--N 1.332 0.355 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.737 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.06 -18.44 0.44 Allowed 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 123.077 0.551 . . . . 0.0 112.202 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -127.79 17.88 6.79 Favored 'General case' 0 N--CA 1.438 -1.045 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.57 -179.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.5 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 23.7 p -85.01 115.61 22.93 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 114.434 1.272 . . . . 0.0 114.434 -177.114 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.407 ' O ' ' CG ' ' A' ' 32' ' ' PHE . 0.1 OUTLIER -112.09 -19.78 12.18 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.188 -1.369 . . . . 0.0 108.192 176.553 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.573 ' CE2' ' HB3' ' A' ' 10' ' ' TYR . 86.6 m-85 -160.75 -157.82 0.56 Allowed 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 114.673 -1.149 . . . . 0.0 109.563 179.507 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.635 ' H ' ' HB2' ' A' ' 13' ' ' GLU . . . 42.34 98.25 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.143 0.177 . . . . 0.0 110.556 179.54 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.738 ' NE2' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -166.15 -142.23 0.05 OUTLIER 'General case' 0 CA--C 1.553 1.075 0 N-CA-C 110.069 -0.345 . . . . 0.0 110.069 -178.241 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.515 ' CA ' ' CE1' ' A' ' 18' ' ' TYR . . . -56.87 -91.09 0.01 OUTLIER Glycine 0 C--N 1.35 1.329 0 N-CA-C 111.664 -0.575 . . . . 0.0 111.664 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.551 ' HB3' HD21 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -78.71 -152.53 0.06 Allowed 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.729 -1.211 . . . . 0.0 107.729 178.409 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.662 ' CA ' ' HA ' ' A' ' 13' ' ' GLU . . . 137.29 -0.03 2.78 Favored Glycine 0 N--CA 1.439 -1.117 0 C-N-CA 119.615 -1.279 . . . . 0.0 114.12 179.251 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -71.42 35.01 0.05 Allowed 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.544 -0.463 . . . . 0.0 111.89 -179.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.619 HD11 HD12 ' A' ' 14' ' ' LEU . 41.9 mt -48.13 -69.38 0.12 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.54 0.686 . . . . 0.0 111.37 179.289 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.569 ' HG2' ' HB ' ' A' ' 12' ' ' THR . 0.1 OUTLIER -75.91 20.71 0.18 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 114.415 -1.266 . . . . 0.0 112.528 -179.019 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.484 ' HG3' ' O ' ' A' ' 40' ' ' ARG . 11.8 mt-30 -150.58 79.39 1.33 Allowed 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 122.797 0.439 . . . . 0.0 110.466 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -44.71 146.45 0.76 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.731 0.301 . . . . 0.0 111.455 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 30.5 p30 . . . . . 0 C--O 1.25 1.119 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.006 -179.929 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.404 ' O ' HG23 ' A' ' 5' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.298 0 CA-C-O 120.869 0.366 . . . . 0.0 110.946 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.404 HG23 ' O ' ' A' ' 4' ' ' MET . 0.7 OUTLIER -159.17 -68.0 0.08 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.096 -179.844 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 69.8 p -90.55 94.7 9.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.953 -179.882 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -94.36 113.44 25.32 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.85 179.924 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.6 m 59.21 89.74 0.06 Allowed 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.778 -179.884 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.557 ' HG3' ' N ' ' A' ' 10' ' ' TYR . 10.7 tpp85 -77.71 155.69 31.11 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.421 179.814 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.6 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.0 m-85 -68.54 -159.21 0.02 OUTLIER 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.459 -0.791 . . . . 0.0 111.249 -179.344 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . 0.483 ' HB2' ' CB ' ' A' ' 32' ' ' PHE . 0.5 OUTLIER -72.94 -164.03 0.15 Allowed 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.865 -178.223 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 3.8 t -129.83 31.06 4.78 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.991 -179.259 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.768 ' C ' HD13 ' A' ' 14' ' ' LEU . 1.4 mt-10 -125.06 -167.52 1.69 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 112.678 0.622 . . . . 0.0 112.678 -179.218 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.812 HD12 HD21 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -166.25 155.88 11.79 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 121.327 0.584 . . . . 0.0 112.061 -178.414 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.62 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.9 t -72.35 78.8 1.01 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.25 179.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.711 ' HG2' HD23 ' A' ' 14' ' ' LEU . 4.8 mmm180 -70.27 -101.53 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -179.021 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.8 t -71.47 -20.65 62.06 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.668 0.746 . . . . 0.0 110.626 -179.931 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.626 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 2.3 m-85 -55.25 -47.05 75.98 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.566 -1.197 . . . . 0.0 111.798 -179.181 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.2 -13.21 0.06 Allowed 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.805 0.669 . . . . 0.0 112.805 -179.282 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -95.41 31.49 1.97 Allowed 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.625 0.726 . . . . 0.0 110.565 179.401 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.5 t 70.55 17.43 6.74 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.841 179.487 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -62.07 -92.41 0.02 OUTLIER Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.784 -0.722 . . . . 0.0 113.128 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HD3' ' N ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -110.98 -61.78 1.64 Allowed 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.982 0.896 . . . . 0.0 111.899 -178.999 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.74 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.6 m 63.71 81.39 0.21 Allowed 'General case' 0 C--N 1.312 -1.045 0 CA-C-N 114.046 -1.434 . . . . 0.0 108.684 -177.877 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.584 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 0.9 OUTLIER -52.51 -19.87 2.55 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.285 -178.401 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.55 ' HB2' ' HA ' ' A' ' 30' ' ' CYS . 17.2 m-85 -137.36 49.55 2.0 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.272 -1.01 . . . . 0.0 108.272 178.149 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.504 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.82 119.98 0.8 Allowed Glycine 0 C--N 1.332 0.329 0 CA-C-N 116.174 -0.467 . . . . 0.0 113.808 -179.188 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 77.14 -20.53 0.37 Allowed 'General case' 0 N--CA 1.463 0.199 0 C-N-CA 122.652 0.381 . . . . 0.0 111.627 -179.38 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.473 ' N ' ' O ' ' A' ' 26' ' ' TYR . 0.0 OUTLIER -118.95 15.38 13.36 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.927 179.891 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.55 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 24.9 p -83.97 130.91 34.88 Favored 'General case' 0 CA--C 1.516 -0.345 0 N-CA-C 114.186 1.18 . . . . 0.0 114.186 -177.013 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -128.26 -18.38 4.09 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 114.056 -1.429 . . . . 0.0 110.201 178.763 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.6 ' CE1' ' HB3' ' A' ' 10' ' ' TYR . 95.3 m-85 -158.16 -74.48 0.09 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 113.277 0.843 . . . . 0.0 113.277 -179.644 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.685 ' O ' ' ND1' ' A' ' 34' ' ' HIS . . . -41.43 105.12 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.796 -177.162 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.74 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.1 OUTLIER -165.53 -133.33 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.189 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 -179.732 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.431 ' H ' ' HB3' ' A' ' 34' ' ' HIS . . . -68.64 -118.7 0.03 OUTLIER Glycine 0 C--N 1.354 1.538 0 CA-C-N 118.584 0.629 . . . . 0.0 111.736 178.98 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.845 HD23 ' H ' ' A' ' 37' ' ' GLY . 0.2 OUTLIER -70.89 -170.17 0.41 Allowed 'General case' 0 N--CA 1.445 -0.694 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 178.286 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.845 ' H ' HD23 ' A' ' 36' ' ' LEU . . . 160.63 -84.64 0.12 Allowed Glycine 0 N--CA 1.441 -1.011 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.457 179.993 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.541 ' HB3' ' HB2' ' A' ' 41' ' ' GLN . 10.2 mt-10 39.55 26.96 0.02 OUTLIER 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 112.58 0.585 . . . . 0.0 112.58 179.423 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.812 HD21 HD12 ' A' ' 14' ' ' LEU . 1.5 mt -41.58 -37.4 1.12 Allowed 'General case' 0 N--CA 1.473 0.703 0 CA-C-O 121.05 0.453 . . . . 0.0 111.822 -179.923 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.499 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -112.49 37.87 2.92 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.666 -179.236 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.541 ' HB2' ' HB3' ' A' ' 38' ' ' GLU . 5.0 mt-30 -146.59 -56.17 0.27 Allowed 'General case' 0 N--CA 1.45 -0.447 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.322 179.468 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 60.3 131.28 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.949 0.404 . . . . 0.0 111.351 -179.574 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . 0.468 ' HB2' ' OE1' ' A' ' 38' ' ' GLU . 0.2 OUTLIER . . . . . 0 C--O 1.248 1.004 0 CA-C-O 118.17 -0.919 . . . . 0.0 110.603 179.776 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.49 1.568 0 CA-C-O 120.792 0.33 . . . . 0.0 111.167 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 18.7 m 56.98 73.65 0.45 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.872 -179.822 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 8.9 t -72.67 145.19 47.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.974 -179.83 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.93 -19.19 18.22 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.029 179.849 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -151.96 -46.72 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.62 179.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 68.7 174.8 0.28 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.412 -179.815 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.432 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 4.7 m-85 -71.5 -163.37 0.09 Allowed 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.615 -179.974 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.4 mtpt -68.07 -172.99 0.34 Allowed 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.46 0.648 . . . . 0.0 112.037 -177.965 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.718 HG22 ' CB ' ' A' ' 40' ' ' ARG . 0.2 OUTLIER -110.09 -22.32 11.86 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.851 -1.068 . . . . 0.0 112.469 -178.445 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.721 ' O ' ' HD2' ' A' ' 32' ' ' PHE . 0.3 OUTLIER -79.4 -178.78 6.43 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -177.164 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.945 HD11 HD12 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -166.25 150.31 7.69 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.067 -178.582 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.625 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 9.2 t -67.74 77.48 0.2 Allowed 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 179.85 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.66 ' HG2' HD23 ' A' ' 14' ' ' LEU . 0.0 OUTLIER -67.02 -95.35 0.0 OUTLIER 'General case' 0 C--N 1.344 0.334 0 N-CA-C 111.89 0.329 . . . . 0.0 111.89 -178.896 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 12.8 t -80.39 -23.07 40.67 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 121.819 0.818 . . . . 0.0 110.054 -179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.701 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -48.42 -44.95 35.64 Favored 'General case' 0 N--CA 1.441 -0.9 0 CA-C-N 114.338 -1.301 . . . . 0.0 111.632 179.922 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -50.93 -11.26 0.08 Allowed 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 113.115 0.783 . . . . 0.0 113.115 -179.334 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -93.71 32.77 1.37 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 121.536 0.684 . . . . 0.0 110.341 179.432 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.6 m 65.45 28.65 11.56 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.629 -1.169 . . . . 0.0 110.664 -179.934 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -74.06 -97.46 0.1 OUTLIER Glycine 0 N--CA 1.439 -1.104 0 CA-C-N 116.048 -0.524 . . . . 0.0 113.062 -179.561 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' HB3' ' CE2' ' A' ' 18' ' ' TYR . 0.0 OUTLIER -104.09 -58.59 1.86 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.719 0.771 . . . . 0.0 111.851 -179.155 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.708 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.7 m 58.04 81.04 0.16 Allowed 'General case' 0 C--N 1.313 -1.015 0 CA-C-N 114.37 -1.286 . . . . 0.0 109.177 -177.825 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 33' ' ' ALA . 6.6 tpm_? -51.64 -18.49 1.19 Allowed 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.148 -178.738 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.687 ' CE2' ' HB3' ' A' ' 33' ' ' ALA . 25.9 m-85 -139.71 44.92 1.93 Allowed 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 178.487 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.424 ' O ' ' HB3' ' A' ' 28' ' ' ALA . . . -37.91 128.88 1.54 Allowed Glycine 0 CA--C 1.52 0.385 0 C-N-CA 121.17 -0.538 . . . . 0.0 113.804 -179.277 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.424 ' HB3' ' O ' ' A' ' 27' ' ' GLY . . . 75.37 -24.49 0.22 Allowed 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.092 0.557 . . . . 0.0 112.051 -179.6 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . 0.411 ' H ' ' C ' ' A' ' 27' ' ' GLY . 5.1 ttpt -121.45 15.97 11.27 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.771 -179.833 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.522 ' N ' ' O ' ' A' ' 26' ' ' TYR . 28.2 p -87.16 114.37 23.71 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -176.475 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.427 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -110.14 -19.12 13.15 Favored 'General case' 0 N--CA 1.439 -1.019 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.769 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.721 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 86.5 m-85 -160.66 -160.99 0.8 Allowed 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 114.73 -1.123 . . . . 0.0 109.896 179.681 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.687 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . 46.58 98.81 0.01 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.436 -0.347 . . . . 0.0 111.73 178.754 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.708 ' CE1' ' HA ' ' A' ' 24' ' ' CYS . 0.2 OUTLIER -163.21 -111.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 116.007 -0.542 . . . . 0.0 109.81 179.369 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.424 ' N ' ' CE1' ' A' ' 18' ' ' TYR . . . -73.45 -127.37 0.12 Allowed Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 -179.62 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . 0.494 ' HG ' ' H ' ' A' ' 38' ' ' GLU . 0.9 OUTLIER -60.44 -74.68 0.07 Allowed 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 179.219 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.657 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 53.88 18.61 8.83 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.842 178.845 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.494 ' H ' ' HG ' ' A' ' 36' ' ' LEU . 7.1 mt-10 -92.6 43.19 1.12 Allowed 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 120.788 0.328 . . . . 0.0 110.218 179.157 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.945 HD12 HD11 ' A' ' 14' ' ' LEU . 4.5 mt -84.74 -20.52 30.98 Favored 'General case' 0 C--N 1.332 -0.154 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.427 -179.815 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.718 ' CB ' HG22 ' A' ' 12' ' ' THR . 0.0 OUTLIER -119.76 36.83 4.38 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.145 179.377 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.694 ' CG ' HG21 ' A' ' 12' ' ' THR . 15.1 mt-30 -148.52 -23.82 0.33 Allowed 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.59 -179.741 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 41' ' ' GLN . . . 68.18 125.25 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.176 0 CA-C-O 120.931 0.396 . . . . 0.0 111.234 179.897 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 C--O 1.25 1.088 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.831 179.955 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.7 ttt . . . . . 0 N--CA 1.488 1.441 0 CA-C-O 120.785 0.326 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -66.76 162.43 21.42 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.73 179.961 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.429 ' O ' ' HB2' ' A' ' 7' ' ' SER . 12.6 p -106.97 -28.28 10.15 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.12 -179.842 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 6' ' ' THR . 1.4 m 68.83 -63.94 0.34 Allowed 'General case' 0 C--O 1.231 0.122 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.903 -179.813 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.9 p -169.05 43.99 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.371 179.67 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ARG . . . . . 0.412 ' HB2' ' HB ' ' A' ' 6' ' ' THR . 0.0 OUTLIER -56.68 177.02 0.08 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.939 -179.688 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . 0.564 ' HB3' ' CE1' ' A' ' 32' ' ' PHE . 3.8 m-85 -79.89 -162.73 0.46 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.784 179.898 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -69.21 -167.85 0.13 Allowed 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.281 0.563 . . . . 0.0 111.701 -178.468 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.42 HG21 ' CG ' ' A' ' 41' ' ' GLN . 0.3 OUTLIER -119.12 -8.86 10.1 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.446 -0.797 . . . . 0.0 112.635 -178.711 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.855 ' C ' HD13 ' A' ' 14' ' ' LEU . 0.7 OUTLIER -81.95 -174.87 5.3 Favored 'General case' 0 N--CA 1.449 -0.52 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -178.177 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.855 HD13 ' C ' ' A' ' 13' ' ' GLU . 0.0 OUTLIER -167.98 154.86 7.93 Favored 'General case' 0 CA--C 1.529 0.156 0 CA-C-O 121.043 0.449 . . . . 0.0 111.506 -178.825 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' CYS . . . . . 0.621 ' HA ' ' CD2' ' A' ' 34' ' ' HIS . 14.8 t -72.47 83.31 1.09 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.226 179.541 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.848 ' HG3' HD23 ' A' ' 14' ' ' LEU . 0.2 OUTLIER -75.86 -101.09 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 111.863 0.319 . . . . 0.0 111.863 -178.345 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 8.8 t -70.89 -20.35 62.52 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 121.783 0.801 . . . . 0.0 109.862 179.603 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.708 ' CD2' ' CG ' ' A' ' 34' ' ' HIS . 3.1 m-85 -55.53 -48.02 75.35 Favored 'General case' 0 N--CA 1.439 -1.02 0 CA-C-N 114.258 -1.337 . . . . 0.0 111.659 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 43.6 t -45.88 -27.85 0.97 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.786 -0.643 . . . . 0.0 112.242 -178.897 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.595 ' O ' ' CB ' ' A' ' 21' ' ' SER . 0.7 OUTLIER -76.3 -31.89 58.45 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.067 -179.802 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.595 ' CB ' ' O ' ' A' ' 20' ' ' GLU . 10.7 t 138.31 2.43 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.809 0 CA-C-N 115.419 -0.809 . . . . 0.0 110.998 -179.995 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -46.78 -38.5 10.06 Favored Glycine 0 C--N 1.332 0.311 0 N-CA-C 114.726 0.651 . . . . 0.0 114.726 -178.899 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -172.47 -62.35 0.02 OUTLIER 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.703 0.763 . . . . 0.0 112.611 -178.396 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.702 ' HA ' ' CE1' ' A' ' 34' ' ' HIS . 1.3 m 65.64 80.88 0.22 Allowed 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.133 -1.394 . . . . 0.0 109.096 -177.72 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.448 ' HB3' ' HD1' ' A' ' 34' ' ' HIS . 1.3 tpm_? -50.25 -21.23 1.28 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.733 -179.319 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.601 ' H ' ' HE1' ' A' ' 34' ' ' HIS . 24.9 m-85 -140.62 55.07 1.59 Allowed 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 178.285 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.669 ' HA2' ' HB3' ' A' ' 24' ' ' CYS . . . -36.64 -35.39 0.12 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 115.61 1.004 . . . . 0.0 115.61 -177.224 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -107.69 -18.48 13.82 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 118.167 0.983 . . . . 0.0 112.085 179.903 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -126.22 28.52 6.02 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.952 -178.162 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' CYS . . . . . 0.593 ' HA ' ' HB2' ' A' ' 26' ' ' TYR . 31.8 p -87.24 116.85 25.6 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 113.942 1.09 . . . . 0.0 113.942 -177.549 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.488 ' OE1' ' N ' ' A' ' 32' ' ' PHE . 0.0 OUTLIER -120.42 -14.02 8.76 Favored 'General case' 0 N--CA 1.433 -1.319 0 CA-C-N 114.31 -1.314 . . . . 0.0 109.945 178.585 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.645 ' HD2' ' O ' ' A' ' 13' ' ' GLU . 96.9 m-85 -158.33 -85.88 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 112.925 0.713 . . . . 0.0 112.925 -178.959 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.594 ' HB3' ' CE2' ' A' ' 26' ' ' TYR . . . -34.9 109.55 0.08 Allowed 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 113.586 0.958 . . . . 0.0 113.586 -177.84 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.708 ' CG ' ' CD2' ' A' ' 18' ' ' TYR . 0.2 OUTLIER -162.95 -112.06 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.287 178.415 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.479 ' HA2' ' CE1' ' A' ' 18' ' ' TYR . . . -58.41 -100.15 0.01 OUTLIER Glycine 0 C--N 1.348 1.226 0 N-CA-C 112.728 -0.149 . . . . 0.0 112.728 -179.237 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -116.3 -42.13 3.06 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 179.838 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.659 ' HA3' ' HA ' ' A' ' 13' ' ' GLU . . . 37.66 72.09 0.19 Allowed Glycine 0 N--CA 1.45 -0.4 0 CA-C-N 115.364 -0.835 . . . . 0.0 113.847 179.478 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -119.12 41.06 3.16 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.955 -0.623 . . . . 0.0 110.227 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.549 HD12 HD12 ' A' ' 14' ' ' LEU . 52.9 mt -72.05 -31.36 66.07 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-O 121.472 0.653 . . . . 0.0 110.691 -179.88 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.482 ' O ' ' HG2' ' A' ' 41' ' ' GLN . 0.0 OUTLIER -119.51 45.35 2.15 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.778 -1.101 . . . . 0.0 110.729 179.813 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.482 ' HG2' ' O ' ' A' ' 40' ' ' ARG . 1.9 mm-40 -146.78 -17.39 0.42 Allowed 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 115.888 -0.597 . . . . 0.0 112.091 -179.929 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 66.79 166.23 0.21 Allowed 'General case' 0 C--O 1.232 0.143 0 CA-C-O 120.815 0.34 . . . . 0.0 111.045 -179.654 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 8.3 m120 . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.85 -179.926 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_