data_1r8t_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 1r8t _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.813 0.339 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -97.19 25.87 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.017 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.419 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.69 169.1 9.0 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.639 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.419 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 67.6 Cg_endo -71.07 -9.68 26.06 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.45 2.1 . . . . 0.0 111.833 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -74.22 -23.79 59.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.863 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.71 -26.47 14.05 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.982 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.86 -143.11 25.33 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.837 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.11 -27.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.747 0.308 . . . . 0.0 111.698 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.41 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.33 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.439 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.81 -178.75 6.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.98 179.751 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.5 m -140.54 47.69 1.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.892 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.934 179.999 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.44 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 21.0 p . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.783 0.325 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -118.62 27.49 8.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.077 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.479 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.46 170.85 4.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.522 179.65 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.479 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 38.3 Cg_endo -64.66 -14.26 43.64 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.365 2.043 . . . . 0.0 111.91 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -62.31 -31.55 72.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.932 0.396 . . . . 0.0 110.604 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -22.74 17.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.926 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.1 -140.35 48.05 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.539 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -17.16 44.46 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.98 26.63 3.13 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -71.18 -178.52 2.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.797 0.332 . . . . 0.0 110.823 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.4 p -149.32 51.83 0.95 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.5 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.94 179.957 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.416 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.4 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.859 0.361 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -98.44 28.75 3.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.437 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.75 169.43 9.17 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.1 Cg_endo -70.49 -10.58 28.28 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.488 2.125 . . . . 0.0 111.809 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.64 -25.16 31.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.765 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -80.04 -29.98 39.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.74 -144.54 26.26 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.881 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.2 -24.57 4.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.676 0.274 . . . . 0.0 111.666 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.24 37.25 1.04 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.442 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.94 -178.47 3.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 0.0 110.904 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.3 p -149.16 47.19 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.72 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.841 -179.902 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.41 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.3 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.908 0.385 . . . . 0.0 110.928 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.2 t -98.44 28.78 3.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.926 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.435 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.77 169.47 9.1 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.668 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.435 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.5 Cg_endo -70.46 -10.65 28.45 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.475 2.117 . . . . 0.0 111.881 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -83.61 -25.12 31.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.774 179.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.2 m -80.04 -29.91 39.36 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.75 -144.53 26.32 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.926 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.42 -24.38 4.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.722 0.296 . . . . 0.0 111.692 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.3 37.08 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.77 -178.47 3.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.858 179.87 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.1 p -149.14 47.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 -179.934 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.424 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.928 0.394 . . . . 0.0 110.811 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -110.77 29.77 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.244 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.424 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -118.44 157.83 48.43 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.907 0.384 . . . . 0.0 111.024 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -43.92 -25.59 1.11 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.169 2.579 . . . . 0.0 113.014 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -59.54 -47.53 85.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.834 0.349 . . . . 0.0 111.061 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 m -77.86 -28.4 50.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.005 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 51.82 -139.44 28.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.897 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.22 -27.95 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.763 0.316 . . . . 0.0 111.579 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.55 41.85 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 1.0 OUTLIER -77.6 -178.07 5.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.952 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -150.91 47.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.8 m . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.999 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.447 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 23.2 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.855 0.36 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 30.7 t -121.0 27.64 8.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.475 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.79 170.76 4.95 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.558 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.475 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.89 -14.21 43.81 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.358 2.039 . . . . 0.0 111.927 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.61 -31.61 72.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.383 . . . . 0.0 110.584 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.1 m -93.35 -20.49 20.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.007 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.12 -139.61 48.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.558 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.1 -14.6 55.91 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.99 21.0 6.1 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -66.5 -178.45 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.795 0.331 . . . . 0.0 110.869 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 m -152.57 53.25 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 30.6 m . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.871 -179.987 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.421 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.6 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.856 0.36 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -98.91 28.99 4.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.432 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.53 169.54 9.09 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.686 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.432 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 63.1 Cg_endo -70.59 -10.48 27.97 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.56 2.173 . . . . 0.0 111.868 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -84.01 -24.88 30.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.744 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.5 m -79.88 -29.13 39.89 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.92 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.94 28.67 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.884 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -24.52 7.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.672 0.272 . . . . 0.0 111.548 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.26 37.4 1.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.291 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.4 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -72.72 -178.23 2.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.869 179.921 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -144.94 47.13 1.34 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.786 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.8 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.885 -179.961 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.853 0.359 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.8 t -106.45 28.79 7.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.889 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.437 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.66 169.88 8.54 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.561 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.0 Cg_endo -70.1 -10.74 28.99 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.506 2.137 . . . . 0.0 111.816 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.99 -25.57 29.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.736 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.2 m -77.37 -29.56 53.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.899 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -145.1 30.86 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.889 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.27 -23.69 9.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.712 0.291 . . . . 0.0 111.617 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.27 1.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.352 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -178.39 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.896 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -147.02 47.12 1.16 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.8 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.97 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.425 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 28.2 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.854 0.359 . . . . 0.0 110.986 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -107.51 -23.55 12.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.933 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.457 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -55.17 168.28 0.57 Allowed Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.95 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.457 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 56.5 Cg_endo -68.58 -11.33 31.61 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.491 2.127 . . . . 0.0 111.911 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -62.31 -25.72 68.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.654 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -99.57 -25.64 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.432 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.03 -145.1 38.09 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.655 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.29 -25.01 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.51 38.4 1.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.569 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.432 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.11 -178.85 6.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.65 50.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.807 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.3 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.927 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -110.22 27.79 9.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.443 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.4 169.91 8.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.642 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.91 -10.85 29.42 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.452 2.101 . . . . 0.0 111.873 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -83.83 -25.74 30.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.763 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.5 m -76.06 -31.63 58.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.848 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.49 -140.41 33.19 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.781 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.06 -22.87 17.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.696 0.284 . . . . 0.0 111.508 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.95 35.14 1.28 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -75.22 -178.61 4.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.869 0.366 . . . . 0.0 110.877 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.49 47.54 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.792 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.5 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.886 -179.978 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.416 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.882 0.372 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -104.34 27.87 7.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.012 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.416 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.11 160.7 30.1 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 120.993 0.425 . . . . 0.0 111.17 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_exo -44.62 -26.91 2.01 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.061 2.508 . . . . 0.0 112.606 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -59.81 -32.08 70.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.971 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.57 -27.23 16.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.17 -149.4 9.54 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.749 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.71 -25.13 1.64 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.89 39.12 1.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.493 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.74 -179.46 6.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.863 0.363 . . . . 0.0 111.084 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -142.53 52.17 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.7 m . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.927 -179.998 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.445 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 18.7 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.794 0.331 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.4 t -116.81 27.15 9.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.124 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.481 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.81 4.96 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.452 179.673 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.481 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.323 2.015 . . . . 0.0 111.922 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -62.02 -31.52 71.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.639 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -96.03 -25.66 15.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.846 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.38 -142.14 47.0 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.549 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.47 -21.65 10.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.04 33.75 1.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.681 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.42 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -77.72 -178.59 5.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.854 0.359 . . . . 0.0 110.872 179.752 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -146.89 50.49 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.851 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.0 m . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.937 179.958 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.0 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.819 0.342 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.8 t -97.67 23.95 7.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.449 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.48 170.44 7.2 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.655 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.449 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.0 Cg_endo -69.56 -11.48 31.21 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.458 2.105 . . . . 0.0 111.829 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -69.37 -27.12 65.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.718 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -98.21 -21.51 16.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.993 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.45 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.38 -148.84 19.8 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.72 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.86 -23.93 1.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.15 36.88 0.98 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.671 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.45 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.7 OUTLIER -80.67 -178.4 6.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.709 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -132.84 47.39 2.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.9 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 6.2 p . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.78 0.324 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -113.71 29.89 7.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.454 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -112.43 169.2 6.61 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.682 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.454 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.6 Cg_endo -70.29 40.49 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.535 2.156 . . . . 0.0 112.236 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.45 ' H ' ' C ' ' A' ' 4' ' ' HIS . 59.4 mm-40 -120.16 -27.31 5.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.388 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -99.02 -6.0 29.36 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.22 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.39 -146.4 37.22 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.58 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.95 -15.44 43.47 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.12 24.06 3.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -62.0 -178.06 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.763 0.316 . . . . 0.0 110.796 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.17 76.61 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.443 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 11.7 p . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.796 0.332 . . . . 0.0 110.888 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.1 t -119.7 26.88 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.471 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.53 170.8 4.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.496 179.731 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.471 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.2 Cg_endo -64.91 -14.05 42.96 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.319 2.013 . . . . 0.0 111.953 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -62.15 -31.66 72.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.908 0.385 . . . . 0.0 110.609 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.99 -22.74 17.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.83 -139.05 48.62 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.501 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.8 -16.27 48.55 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.78 24.79 3.93 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -69.43 -178.53 1.41 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.809 0.338 . . . . 0.0 110.882 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -141.95 54.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.85 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.823 0.344 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.2 t -108.76 28.43 8.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.887 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.44 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.41 169.99 8.46 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.618 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.44 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.5 Cg_endo -69.93 -10.92 29.56 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.446 2.097 . . . . 0.0 111.814 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.88 -25.77 29.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.796 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.1 m -76.36 -29.85 57.36 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.9 -144.12 31.83 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.828 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.18 -22.92 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.676 0.274 . . . . 0.0 111.594 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.13 35.24 1.19 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.334 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.8 OUTLIER -70.71 -178.34 1.82 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.852 0.358 . . . . 0.0 110.87 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.49 47.04 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.798 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.8 m . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.829 -179.938 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.425 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 13.0 p . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.812 0.339 . . . . 0.0 110.875 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.6 t -114.62 26.77 9.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.11 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.484 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.85 4.93 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.502 179.602 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.345 2.03 . . . . 0.0 111.948 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -61.5 -31.36 71.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.864 0.364 . . . . 0.0 110.611 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.04 -25.02 15.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.911 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.51 -141.18 47.56 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.591 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.47 -21.13 14.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.63 0.252 . . . . 0.0 111.633 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.41 33.3 1.42 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.607 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.425 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.53 -178.5 4.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.828 0.346 . . . . 0.0 110.885 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -146.07 63.98 1.23 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.914 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.426 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 28.6 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.834 0.35 . . . . 0.0 110.989 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.6 t -121.64 28.18 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.922 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.473 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.9 170.64 5.06 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.517 179.737 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.473 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.93 -14.26 44.19 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.311 2.008 . . . . 0.0 111.945 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.18 -31.5 72.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.886 0.374 . . . . 0.0 110.565 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -91.28 -19.29 23.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.413 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 61.2 -140.96 47.92 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.493 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.78 -12.23 60.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.584 0.23 . . . . 0.0 111.615 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.86 12.67 16.61 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.413 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -60.51 -178.62 0.09 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 110.83 179.95 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.0 m -154.1 53.3 0.69 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.803 0.335 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -97.59 25.62 5.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.441 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.98 8.04 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.677 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.441 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.7 Cg_endo -70.56 -10.59 28.24 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.444 2.096 . . . . 0.0 111.811 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -73.11 -25.16 60.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.793 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.33 -28.17 14.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.855 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.435 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.51 -144.58 29.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.806 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.79 -26.3 1.57 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.89 39.51 1.04 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.487 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.435 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.53 -178.67 6.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.815 0.34 . . . . 0.0 110.928 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -143.48 49.98 1.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.882 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.898 -179.988 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.42 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 4.8 p . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.808 0.337 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.7 t -116.18 30.27 7.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.018 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.444 ' C ' ' H ' ' A' ' 6' ' ' GLN . 0.1 OUTLIER -113.26 169.14 6.74 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.688 179.703 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.439 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -70.4 40.42 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.564 2.176 . . . . 0.0 112.165 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -120.17 -27.06 5.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.257 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -99.42 -11.36 21.2 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.216 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.428 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 58.42 -145.77 41.56 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.545 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -17.13 30.75 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.59 27.25 2.71 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.428 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -65.55 -178.11 0.5 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.793 0.33 . . . . 0.0 110.845 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.13 47.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.814 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.1 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.904 179.982 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.874 0.369 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t -106.44 28.58 7.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.883 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.437 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.68 169.89 8.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.604 179.956 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.98 -10.81 29.26 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.437 2.091 . . . . 0.0 111.881 179.715 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -83.65 -25.82 30.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.739 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.0 m -77.5 -29.43 52.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.963 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.85 -145.07 29.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.797 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.13 -23.79 8.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.644 0.259 . . . . 0.0 111.604 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.35 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.327 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -71.65 -178.35 2.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.888 179.88 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.97 47.18 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.907 -179.983 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.861 0.362 . . . . 0.0 110.887 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -104.44 27.9 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.958 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.09 160.71 30.01 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.97 0.414 . . . . 0.0 111.125 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.53 -27.03 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.146 2.564 . . . . 0.0 112.583 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -32.31 70.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.39 -27.24 16.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.901 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.08 -149.56 9.2 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.743 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.42 -25.23 1.54 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.9 39.27 1.07 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.488 -179.805 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.9 -179.41 6.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.86 0.362 . . . . 0.0 111.07 179.785 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.7 m -142.41 52.0 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.828 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.9 m . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.926 179.996 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.809 0.338 . . . . 0.0 110.882 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.0 t -97.65 25.48 5.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.917 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.435 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.96 8.08 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.688 -179.945 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.435 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.6 Cg_endo -70.57 -10.49 28.02 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.454 2.103 . . . . 0.0 111.799 179.727 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 tm0? -73.03 -25.22 60.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.785 179.597 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.31 -27.86 14.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.841 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.436 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.53 29.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.747 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.58 -26.51 1.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.671 0.272 . . . . 0.0 111.68 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 39.68 1.04 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.522 -179.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.436 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.84 -178.63 6.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.888 179.811 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -144.95 56.9 1.27 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.4 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.878 -179.985 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.4 p . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.826 0.345 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.9 t -98.09 25.7 5.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.435 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.53 169.86 8.27 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.706 -179.966 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.435 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 64.5 Cg_endo -70.67 -10.92 28.81 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.529 2.153 . . . . 0.0 111.865 179.748 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.28 -24.61 60.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.77 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.35 -27.98 14.24 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.42 -145.01 28.25 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.828 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.27 -26.65 1.28 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -179.893 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.83 39.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.467 -179.848 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.94 -178.51 6.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.955 179.718 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.96 47.91 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.895 179.98 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.4 m . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.907 -179.978 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.2 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.795 0.331 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 t -97.11 25.98 5.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.013 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.426 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.8 169.13 8.94 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.678 179.995 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.426 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 66.9 Cg_endo -71.01 -9.9 26.53 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.443 2.095 . . . . 0.0 111.819 179.754 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mp0 -73.89 -24.06 59.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.881 179.65 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.65 -26.44 14.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.944 179.963 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.44 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.01 -143.25 25.82 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.825 179.741 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.19 -27.98 1.13 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.702 0.287 . . . . 0.0 111.679 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.34 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.332 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.44 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.59 -178.9 6.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.988 179.781 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 m -140.07 47.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.841 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.3 m . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.973 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.436 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 31.8 p . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.82 0.343 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -126.75 27.48 6.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.436 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.64 159.41 35.7 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 111.171 -179.985 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.29 -25.41 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 123.142 2.561 . . . . 0.0 112.763 -179.914 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -59.62 -26.98 65.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.101 -179.797 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.01 -22.1 15.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.051 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.21 -143.35 41.18 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.695 179.888 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.29 55.66 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -179.861 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.07 8.49 20.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.431 ' CD1' ' N ' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -59.81 -178.76 0.08 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.858 0.361 . . . . 0.0 111.035 -179.946 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -144.49 47.44 1.37 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.813 179.911 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.921 179.985 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 N--CA 1.458 -0.04 0 CA-C-O 120.834 0.35 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 t -117.62 28.84 8.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 179.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.466 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.43 171.33 6.32 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.382 179.828 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.466 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 56.4 Cg_endo -67.83 -11.66 32.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.383 2.055 . . . . 0.0 111.866 179.746 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -82.1 -29.36 31.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 110.787 179.638 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.6 -27.62 58.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.08 -146.51 23.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.966 179.696 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.78 -24.34 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.725 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.73 37.25 1.01 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.36 -179.976 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 43.9 p90 -75.31 -174.12 2.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.858 0.361 . . . . 0.0 111.002 179.953 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -161.82 73.55 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.708 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.846 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.443 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 29.8 p . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.839 0.352 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -124.86 27.72 6.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.046 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.443 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -112.06 161.81 24.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.169 179.965 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -43.37 -25.99 0.87 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.27 2.647 . . . . 0.0 112.843 -179.891 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -59.64 -32.8 70.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -100.05 -29.13 12.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.9 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.77 -144.42 30.79 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.788 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.26 -26.93 1.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.1 40.33 1.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.467 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.64 -178.91 6.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.787 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -133.83 47.17 2.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.873 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.864 0.364 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -98.47 25.31 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.882 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.443 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.74 170.08 7.89 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.677 -179.975 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.4 Cg_endo -70.33 -10.8 28.91 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.453 2.102 . . . . 0.0 111.775 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -72.37 -25.81 61.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.758 179.599 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.0 -28.18 14.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.423 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.63 -144.47 30.08 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.819 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.87 -25.5 1.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.723 0.297 . . . . 0.0 111.728 -179.816 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 38.49 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.474 -179.828 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.423 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.14 -178.65 6.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 0.0 110.909 179.729 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -140.81 47.97 1.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.851 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.421 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.803 0.335 . . . . 0.0 110.855 . . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.4 t -116.37 27.93 8.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.063 -179.955 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' HIS . . . . . 0.429 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -114.02 169.49 6.47 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.616 179.746 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . 0.429 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 58.9 Cg_endo -69.4 41.86 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.545 2.163 . . . . 0.0 112.275 -179.899 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.429 ' H ' ' C ' ' A' ' 4' ' ' HIS . 6.8 mt-30 -120.28 -28.71 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.236 179.201 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.03 -23.16 14.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.031 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.15 -140.18 48.1 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.481 -179.911 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.39 -22.82 13.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.691 0.281 . . . . 0.0 111.558 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -95.67 35.76 1.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.528 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' TYR . . . . . 0.416 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.55 -178.7 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.909 179.766 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -130.71 53.38 1.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.886 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.83 0.347 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.0 t -146.82 72.61 1.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.883 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -97.19 25.87 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.017 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.419 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.69 169.1 9.0 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.639 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.419 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 67.6 Cg_endo -71.07 -9.68 26.06 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.45 2.1 . . . . 0.0 111.833 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -74.22 -23.79 59.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.863 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.71 -26.47 14.05 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.982 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.86 -143.11 25.33 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.837 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.11 -27.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.747 0.308 . . . . 0.0 111.698 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.41 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.33 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.439 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.81 -178.75 6.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.98 179.751 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.5 m -140.54 47.69 1.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.892 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.2 m -60.85 -35.74 77.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.934 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -160.01 -48.39 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.935 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.7 mttm . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.922 179.963 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.879 0.371 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.44 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 21.0 p -160.01 118.01 2.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.948 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -118.62 27.49 8.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.077 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.479 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.46 170.85 4.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.522 179.65 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.479 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 38.3 Cg_endo -64.66 -14.26 43.64 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.365 2.043 . . . . 0.0 111.91 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -62.31 -31.55 72.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.932 0.396 . . . . 0.0 110.604 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -22.74 17.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.926 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.1 -140.35 48.05 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.539 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -17.16 44.46 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.98 26.63 3.13 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -71.18 -178.52 2.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.797 0.332 . . . . 0.0 110.823 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.4 p -149.32 51.83 0.95 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.5 m -60.02 -67.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.94 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.96 81.13 0.71 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.935 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.3 mttt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.896 -179.992 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.847 0.356 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.416 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.4 t -141.42 54.12 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.847 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -98.44 28.75 3.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.437 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.75 169.43 9.17 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.1 Cg_endo -70.49 -10.58 28.28 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.488 2.125 . . . . 0.0 111.809 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.64 -25.16 31.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.765 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -80.04 -29.98 39.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.74 -144.54 26.26 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.881 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.2 -24.57 4.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.676 0.274 . . . . 0.0 111.666 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.24 37.25 1.04 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.442 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.94 -178.47 3.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 0.0 110.904 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.3 p -149.16 47.19 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.72 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m -67.94 -32.93 73.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.841 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -160.02 -67.55 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.831 0.348 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.41 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.3 t -135.51 54.07 1.94 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.928 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.2 t -98.44 28.78 3.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.926 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.435 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.77 169.47 9.1 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.668 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.435 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.5 Cg_endo -70.46 -10.65 28.45 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.475 2.117 . . . . 0.0 111.881 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -83.61 -25.12 31.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.774 179.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.2 m -80.04 -29.91 39.36 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.75 -144.53 26.32 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.926 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.42 -24.38 4.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.722 0.296 . . . . 0.0 111.692 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.3 37.08 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.77 -178.47 3.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.858 179.87 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.1 p -149.14 47.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m -67.82 179.28 1.47 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.28 32.6 4.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.897 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.7 mttt . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.899 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.852 0.358 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.424 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.1 OUTLIER -144.51 49.54 1.32 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.811 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -110.77 29.77 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.244 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.424 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -118.44 157.83 48.43 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.907 0.384 . . . . 0.0 111.024 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -43.92 -25.59 1.11 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.169 2.579 . . . . 0.0 113.014 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -59.54 -47.53 85.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.834 0.349 . . . . 0.0 111.061 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 m -77.86 -28.4 50.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.005 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 51.82 -139.44 28.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.897 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.22 -27.95 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.763 0.316 . . . . 0.0 111.579 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.55 41.85 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 1.0 OUTLIER -77.6 -178.07 5.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.952 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -150.91 47.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.8 m -62.3 135.18 57.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.01 -65.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.924 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.0 mttp . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.901 179.964 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 26.2 mmt-85 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.844 0.354 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.447 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 23.2 p -121.61 120.31 34.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.971 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 30.7 t -121.0 27.64 8.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.475 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.79 170.76 4.95 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.558 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.475 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.89 -14.21 43.81 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.358 2.039 . . . . 0.0 111.927 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.61 -31.61 72.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.383 . . . . 0.0 110.584 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.1 m -93.35 -20.49 20.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.007 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.12 -139.61 48.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.558 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.1 -14.6 55.91 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.99 21.0 6.1 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -66.5 -178.45 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.795 0.331 . . . . 0.0 110.869 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 m -152.57 53.25 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 30.6 m -60.05 107.66 0.66 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.871 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -135.28 -48.16 0.71 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.925 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.5 mttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.875 179.958 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.2 mtm180 . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.856 0.36 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.421 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.6 t -153.68 55.8 0.74 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.881 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -98.91 28.99 4.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.432 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.53 169.54 9.09 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.686 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.432 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 63.1 Cg_endo -70.59 -10.48 27.97 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.56 2.173 . . . . 0.0 111.868 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -84.01 -24.88 30.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.744 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.5 m -79.88 -29.13 39.89 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.92 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.94 28.67 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.884 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -24.52 7.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.672 0.272 . . . . 0.0 111.548 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.26 37.4 1.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.291 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.4 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -72.72 -178.23 2.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.869 179.921 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -144.94 47.13 1.34 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.786 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.8 m -69.8 -173.83 0.67 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.885 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -101.07 31.87 3.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.878 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.906 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.837 0.351 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t -152.74 66.49 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.8 t -106.45 28.79 7.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.889 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.437 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.66 169.88 8.54 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.561 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.0 Cg_endo -70.1 -10.74 28.99 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.506 2.137 . . . . 0.0 111.816 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.99 -25.57 29.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.736 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.2 m -77.37 -29.56 53.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.899 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -145.1 30.86 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.889 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.27 -23.69 9.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.712 0.291 . . . . 0.0 111.617 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.27 1.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.352 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -178.39 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.896 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -147.02 47.12 1.16 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.8 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m -69.52 -66.31 0.6 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -159.46 -69.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.895 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.9 pttm . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.918 179.963 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.3 mmp_? . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.797 0.332 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.425 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 28.2 p -128.67 113.86 15.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.986 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -107.51 -23.55 12.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.933 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.457 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -55.17 168.28 0.57 Allowed Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.95 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.457 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 56.5 Cg_endo -68.58 -11.33 31.61 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.491 2.127 . . . . 0.0 111.911 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -62.31 -25.72 68.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.654 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -99.57 -25.64 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.432 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.03 -145.1 38.09 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.655 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.29 -25.01 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.51 38.4 1.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.569 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.432 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.11 -178.85 6.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.65 50.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.807 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.3 m -59.99 -169.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.927 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.29 36.96 1.51 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.858 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.936 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.0 ptt-85 . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.779 0.323 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t -132.81 71.46 1.47 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.919 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -110.22 27.79 9.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.443 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.4 169.91 8.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.642 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.91 -10.85 29.42 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.452 2.101 . . . . 0.0 111.873 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -83.83 -25.74 30.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.763 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.5 m -76.06 -31.63 58.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.848 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.49 -140.41 33.19 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.781 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.06 -22.87 17.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.696 0.284 . . . . 0.0 111.508 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.95 35.14 1.28 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -75.22 -178.61 4.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.869 0.366 . . . . 0.0 110.877 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.49 47.54 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.792 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.5 m -65.72 -66.9 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.886 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -152.58 -61.87 0.16 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 71.9 mttt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.917 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.86 0.362 . . . . 0.0 111.134 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.416 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -145.61 53.32 1.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -104.34 27.87 7.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.012 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.416 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.11 160.7 30.1 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 120.993 0.425 . . . . 0.0 111.17 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_exo -44.62 -26.91 2.01 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.061 2.508 . . . . 0.0 112.606 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -59.81 -32.08 70.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.971 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.57 -27.23 16.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.17 -149.4 9.54 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.749 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.71 -25.13 1.64 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.89 39.12 1.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.493 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.74 -179.46 6.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.863 0.363 . . . . 0.0 111.084 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -142.53 52.17 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.7 m -59.96 158.48 10.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.927 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.96 33.44 0.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.927 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.1 pttp . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.956 179.987 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 31.8 mtt85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.784 0.326 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.445 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 18.7 p -150.15 116.47 5.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.95 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.4 t -116.81 27.15 9.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.124 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.481 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.81 4.96 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.452 179.673 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.481 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.323 2.015 . . . . 0.0 111.922 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -62.02 -31.52 71.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.639 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -96.03 -25.66 15.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.846 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.38 -142.14 47.0 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.549 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.47 -21.65 10.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.04 33.75 1.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.681 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.42 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -77.72 -178.59 5.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.854 0.359 . . . . 0.0 110.872 179.752 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -146.89 50.49 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.851 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.0 m -59.98 -31.38 69.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.937 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -132.83 35.51 3.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.946 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.901 -179.995 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.1 mtp85 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.861 0.362 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.0 p -160.03 98.68 1.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.016 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.8 t -97.67 23.95 7.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.449 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.48 170.44 7.2 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.655 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.449 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.0 Cg_endo -69.56 -11.48 31.21 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.458 2.105 . . . . 0.0 111.829 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -69.37 -27.12 65.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.718 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -98.21 -21.51 16.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.993 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.45 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.38 -148.84 19.8 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.72 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.86 -23.93 1.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.15 36.88 0.98 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.671 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.45 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.7 OUTLIER -80.67 -178.4 6.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.709 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -132.84 47.39 2.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.94 -167.8 1.55 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.9 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.3 mtm105 -79.97 92.89 5.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.922 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.865 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.7 ttt85 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.781 0.324 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.416 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 6.2 p -145.69 108.95 4.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.893 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -113.71 29.89 7.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.454 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -112.43 169.2 6.61 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.682 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.454 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.6 Cg_endo -70.29 40.49 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.535 2.156 . . . . 0.0 112.236 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.45 ' H ' ' C ' ' A' ' 4' ' ' HIS . 59.4 mm-40 -120.16 -27.31 5.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.388 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -99.02 -6.0 29.36 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.22 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.39 -146.4 37.22 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.58 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.95 -15.44 43.47 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.12 24.06 3.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -62.0 -178.06 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.763 0.316 . . . . 0.0 110.796 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.17 76.61 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.08 175.19 7.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.99 -51.53 8.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.91 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 20.3 mttp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.899 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.8 mtp180 . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.876 0.37 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.443 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 11.7 p -113.36 121.41 44.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.1 t -119.7 26.88 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.471 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.53 170.8 4.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.496 179.731 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.471 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.2 Cg_endo -64.91 -14.05 42.96 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.319 2.013 . . . . 0.0 111.953 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -62.15 -31.66 72.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.908 0.385 . . . . 0.0 110.609 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.99 -22.74 17.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.83 -139.05 48.62 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.501 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.8 -16.27 48.55 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.78 24.79 3.93 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -69.43 -178.53 1.41 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.809 0.338 . . . . 0.0 110.882 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -141.95 54.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.45 -34.17 15.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.85 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.98 -67.57 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.877 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.918 -179.997 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.846 0.355 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t -155.5 69.77 0.7 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.2 t -108.76 28.43 8.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.887 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.44 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.41 169.99 8.46 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.618 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.44 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.5 Cg_endo -69.93 -10.92 29.56 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.446 2.097 . . . . 0.0 111.814 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.88 -25.77 29.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.796 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.1 m -76.36 -29.85 57.36 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.9 -144.12 31.83 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.828 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.18 -22.92 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.676 0.274 . . . . 0.0 111.594 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.13 35.24 1.19 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.334 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.8 OUTLIER -70.71 -178.34 1.82 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.852 0.358 . . . . 0.0 110.87 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.49 47.04 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.798 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.8 m -69.67 -35.44 75.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.829 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -160.02 147.6 16.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.868 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 42.1 mttm . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.908 -179.989 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.77 0.319 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.425 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 13.0 p -144.78 115.17 7.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.6 t -114.62 26.77 9.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.11 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.484 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.85 4.93 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.502 179.602 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.345 2.03 . . . . 0.0 111.948 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -61.5 -31.36 71.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.864 0.364 . . . . 0.0 110.611 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.04 -25.02 15.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.911 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.51 -141.18 47.56 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.591 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.47 -21.13 14.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.63 0.252 . . . . 0.0 111.633 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.41 33.3 1.42 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.607 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.425 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.53 -178.5 4.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.828 0.346 . . . . 0.0 110.885 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -146.07 63.98 1.23 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.914 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.61 129.45 34.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.902 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.56 -51.97 3.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.878 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.3 mttt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.888 179.996 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.77 0.319 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.426 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 28.6 p -95.82 117.38 30.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.989 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.6 t -121.64 28.18 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.922 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.473 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.9 170.64 5.06 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.517 179.737 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.473 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.93 -14.26 44.19 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.311 2.008 . . . . 0.0 111.945 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.18 -31.5 72.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.886 0.374 . . . . 0.0 110.565 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -91.28 -19.29 23.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.413 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 61.2 -140.96 47.92 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.493 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.78 -12.23 60.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.584 0.23 . . . . 0.0 111.615 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.86 12.67 16.61 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.413 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -60.51 -178.62 0.09 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 110.83 179.95 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.0 m -154.1 53.3 0.69 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -66.12 146.85 54.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 ptt85 -108.14 -39.56 5.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.885 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.877 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.769 0.319 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -160.0 97.5 1.28 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.92 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -97.59 25.62 5.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.441 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.98 8.04 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.677 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.441 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.7 Cg_endo -70.56 -10.59 28.24 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.444 2.096 . . . . 0.0 111.811 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -73.11 -25.16 60.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.793 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.33 -28.17 14.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.855 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.435 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.51 -144.58 29.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.806 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.79 -26.3 1.57 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.89 39.51 1.04 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.487 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.435 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.53 -178.67 6.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.815 0.34 . . . . 0.0 110.928 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -143.48 49.98 1.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.882 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 m -61.58 85.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.8 mmm-85 -106.84 88.77 2.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.6 mttm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.911 -179.99 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.825 0.345 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.42 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 4.8 p -149.23 113.07 5.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.924 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.7 t -116.18 30.27 7.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.018 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.444 ' C ' ' H ' ' A' ' 6' ' ' GLN . 0.1 OUTLIER -113.26 169.14 6.74 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.688 179.703 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.439 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -70.4 40.42 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.564 2.176 . . . . 0.0 112.165 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.444 ' H ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -120.17 -27.06 5.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.257 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -99.42 -11.36 21.2 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.216 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.428 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 58.42 -145.77 41.56 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.545 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -17.13 30.75 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.59 27.25 2.71 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.428 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -65.55 -178.11 0.5 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.793 0.33 . . . . 0.0 110.845 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.13 47.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.814 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.1 m -61.35 85.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.904 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -114.07 -65.45 1.19 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.899 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.902 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.1 ttp85 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.923 0.392 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t -143.83 66.04 1.3 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.887 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t -106.44 28.58 7.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.883 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.437 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.68 169.89 8.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.604 179.956 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.98 -10.81 29.26 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.437 2.091 . . . . 0.0 111.881 179.715 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -83.65 -25.82 30.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.739 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.0 m -77.5 -29.43 52.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.963 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.85 -145.07 29.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.797 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.13 -23.79 8.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.644 0.259 . . . . 0.0 111.604 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.35 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.327 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -71.65 -178.35 2.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.888 179.88 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.97 47.18 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m -69.44 154.08 42.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.94 152.47 21.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.867 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.6 mttt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.897 179.969 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.4 tpp180 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.861 0.362 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -140.19 53.32 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.887 179.959 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -104.44 27.9 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.958 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.09 160.71 30.01 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.97 0.414 . . . . 0.0 111.125 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.53 -27.03 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.146 2.564 . . . . 0.0 112.583 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -32.31 70.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.39 -27.24 16.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.901 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.08 -149.56 9.2 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.743 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.42 -25.23 1.54 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.9 39.27 1.07 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.488 -179.805 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.9 -179.41 6.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.86 0.362 . . . . 0.0 111.07 179.785 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.7 m -142.41 52.0 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.828 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.9 m -59.97 -31.61 70.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.926 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.07 35.38 4.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.899 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 pttt . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.895 179.974 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.838 0.351 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -159.99 97.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.882 -179.992 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.0 t -97.65 25.48 5.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.917 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.435 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.96 8.08 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.688 -179.945 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.435 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.6 Cg_endo -70.57 -10.49 28.02 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.454 2.103 . . . . 0.0 111.799 179.727 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 tm0? -73.03 -25.22 60.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.785 179.597 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.31 -27.86 14.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.841 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.436 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.53 29.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.747 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.58 -26.51 1.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.671 0.272 . . . . 0.0 111.68 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 39.68 1.04 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.522 -179.813 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.436 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.84 -178.63 6.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.888 179.811 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -144.95 56.9 1.27 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.4 m -69.28 94.16 0.68 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.878 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -134.65 -66.49 0.6 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.873 179.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.8 pttt . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.854 -179.982 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.793 0.33 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.4 p -159.76 98.16 1.34 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.002 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.9 t -98.09 25.7 5.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.435 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.53 169.86 8.27 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.706 -179.966 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.435 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 64.5 Cg_endo -70.67 -10.92 28.81 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.529 2.153 . . . . 0.0 111.865 179.748 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.28 -24.61 60.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.77 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.35 -27.98 14.24 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.42 -145.01 28.25 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.828 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.27 -26.65 1.28 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -179.893 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.83 39.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.467 -179.848 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.94 -178.51 6.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.955 179.718 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.96 47.91 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.895 179.98 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.4 m -60.0 119.07 7.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.907 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -147.81 -58.03 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.917 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 93.5 mtm-85 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.846 0.355 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.2 t -146.88 72.66 1.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 t -97.11 25.98 5.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.013 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.426 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.8 169.13 8.94 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.678 179.995 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.426 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 66.9 Cg_endo -71.01 -9.9 26.53 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.443 2.095 . . . . 0.0 111.819 179.754 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mp0 -73.89 -24.06 59.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.881 179.65 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.65 -26.44 14.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.944 179.963 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.44 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.01 -143.25 25.82 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.825 179.741 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.19 -27.98 1.13 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.702 0.287 . . . . 0.0 111.679 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.34 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.332 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.44 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.59 -178.9 6.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.988 179.781 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 m -140.07 47.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.841 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.3 m -60.7 -67.31 0.41 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -131.74 -173.12 3.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.884 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.3 mttp . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.907 179.993 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.823 0.344 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.436 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 31.8 p -112.95 120.93 43.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -126.75 27.48 6.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.436 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.64 159.41 35.7 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 111.171 -179.985 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.29 -25.41 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 123.142 2.561 . . . . 0.0 112.763 -179.914 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -59.62 -26.98 65.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.101 -179.797 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.01 -22.1 15.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.051 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.21 -143.35 41.18 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.695 179.888 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.29 55.66 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -179.861 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.07 8.49 20.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.431 ' CD1' ' N ' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -59.81 -178.76 0.08 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.858 0.361 . . . . 0.0 111.035 -179.946 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -144.49 47.44 1.37 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.813 179.911 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.27 -169.62 0.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.921 179.985 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.09 31.2 1.77 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.895 -179.979 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.8 mtpm? . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.856 -179.991 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.837 0.351 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t -146.01 76.26 1.45 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.903 -179.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 t -117.62 28.84 8.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 179.804 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.466 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.43 171.33 6.32 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.382 179.828 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.466 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 56.4 Cg_endo -67.83 -11.66 32.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.383 2.055 . . . . 0.0 111.866 179.746 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -82.1 -29.36 31.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 110.787 179.638 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.6 -27.62 58.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.08 -146.51 23.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.966 179.696 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.78 -24.34 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.725 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.73 37.25 1.01 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.36 -179.976 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 43.9 p90 -75.31 -174.12 2.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.858 0.361 . . . . 0.0 111.002 179.953 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -161.82 73.55 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.708 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 -169.39 2.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.846 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 tpt85 -149.54 79.47 1.39 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 -179.99 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.852 0.358 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.443 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 29.8 p -159.98 117.76 2.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.901 -179.998 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -124.86 27.72 6.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.046 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.443 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -112.06 161.81 24.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.169 179.965 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -43.37 -25.99 0.87 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.27 2.647 . . . . 0.0 112.843 -179.891 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -59.64 -32.8 70.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -100.05 -29.13 12.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.9 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.77 -144.42 30.79 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.788 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.26 -26.93 1.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.1 40.33 1.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.467 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.64 -178.91 6.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.787 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -133.83 47.17 2.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.08 -169.25 0.89 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.873 -179.99 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.89 79.6 9.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 179.992 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.2 mtmt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.934 179.995 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.9 0.381 . . . . 0.0 111.184 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -140.32 97.84 3.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.904 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -98.47 25.31 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.882 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.443 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.74 170.08 7.89 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.677 -179.975 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.4 Cg_endo -70.33 -10.8 28.91 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.453 2.102 . . . . 0.0 111.775 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -72.37 -25.81 61.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.758 179.599 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.0 -28.18 14.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.423 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.63 -144.47 30.08 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.819 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.87 -25.5 1.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.723 0.297 . . . . 0.0 111.728 -179.816 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 38.49 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.474 -179.828 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.423 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.14 -178.65 6.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 0.0 110.909 179.729 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -140.81 47.97 1.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.851 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.57 -33.53 74.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.901 179.977 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -153.38 79.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.947 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.874 -179.942 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.792 0.33 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.421 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.9 OUTLIER -80.09 78.75 6.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.855 -179.991 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.4 t -116.37 27.93 8.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.063 -179.955 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.429 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -114.02 169.49 6.47 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.616 179.746 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.429 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 58.9 Cg_endo -69.4 41.86 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.545 2.163 . . . . 0.0 112.275 -179.899 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.429 ' H ' ' C ' ' A' ' 4' ' ' HIS . 6.8 mt-30 -120.28 -28.71 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.236 179.201 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.03 -23.16 14.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.031 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.15 -140.18 48.1 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.481 -179.911 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.39 -22.82 13.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.691 0.281 . . . . 0.0 111.558 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -95.67 35.76 1.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.528 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' TYR . . . . . 0.416 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.55 -178.7 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.909 179.766 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -130.71 53.38 1.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.886 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.02 -31.57 8.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -119.85 -45.34 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.932 179.995 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.7 mtmt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.905 179.991 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.813 0.339 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -97.19 25.87 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.017 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.428 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.69 169.1 9.0 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.639 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 67.6 Cg_endo -71.07 -9.68 26.06 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.45 2.1 . . . . 0.0 111.833 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -74.22 -23.79 59.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.863 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.71 -26.47 14.05 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.982 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.86 -143.11 25.33 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.837 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.11 -27.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.747 0.308 . . . . 0.0 111.698 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.41 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.33 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.439 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.81 -178.75 6.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.98 179.751 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.5 m -140.54 47.69 1.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.892 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.934 179.999 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 21.0 p . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.783 0.325 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -118.62 27.49 8.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.077 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.487 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.46 170.85 4.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.522 179.65 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 38.3 Cg_endo -64.66 -14.26 43.64 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.365 2.043 . . . . 0.0 111.91 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -62.31 -31.55 72.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.932 0.396 . . . . 0.0 110.604 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -22.74 17.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.926 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.1 -140.35 48.05 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.539 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -17.16 44.46 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.98 26.63 3.13 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -71.18 -178.52 2.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.797 0.332 . . . . 0.0 110.823 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.4 p -149.32 51.83 0.95 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.5 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.94 179.957 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.688 ' N ' ' HG ' ' A' ' 12' ' ' SER . 1.4 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.859 0.361 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -98.44 28.75 3.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.448 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.75 169.43 9.17 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.448 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.1 Cg_endo -70.49 -10.58 28.28 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.488 2.125 . . . . 0.0 111.809 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.64 -25.16 31.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.765 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -80.04 -29.98 39.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.74 -144.54 26.26 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.881 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.2 -24.57 4.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.676 0.274 . . . . 0.0 111.666 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.24 37.25 1.04 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.442 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.94 -178.47 3.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 0.0 110.904 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.688 ' HG ' ' N ' ' A' ' 2' ' ' CYS . 12.3 p -149.16 47.19 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.72 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.841 -179.902 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.678 ' N ' ' HG ' ' A' ' 12' ' ' SER . 1.3 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.908 0.385 . . . . 0.0 110.928 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.2 t -98.44 28.78 3.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.926 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.446 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.77 169.47 9.1 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.668 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.446 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.5 Cg_endo -70.46 -10.65 28.45 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.475 2.117 . . . . 0.0 111.881 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -83.61 -25.12 31.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.774 179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.2 m -80.04 -29.91 39.36 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.75 -144.53 26.32 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.926 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.42 -24.38 4.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.722 0.296 . . . . 0.0 111.692 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.3 37.08 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.77 -178.47 3.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.858 179.87 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.678 ' HG ' ' N ' ' A' ' 2' ' ' CYS . 12.1 p -149.14 47.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 -179.934 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.435 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.928 0.394 . . . . 0.0 110.811 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -110.77 29.77 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.244 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.435 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -118.44 157.83 48.43 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.907 0.384 . . . . 0.0 111.024 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -43.92 -25.59 1.11 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.169 2.579 . . . . 0.0 113.014 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -59.54 -47.53 85.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.834 0.349 . . . . 0.0 111.061 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 m -77.86 -28.4 50.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.005 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 51.82 -139.44 28.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.897 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.22 -27.95 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.763 0.316 . . . . 0.0 111.579 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.55 41.85 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 1.0 OUTLIER -77.6 -178.07 5.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.952 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -150.91 47.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.8 m . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.999 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.476 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 23.2 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.855 0.36 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 30.7 t -121.0 27.64 8.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.486 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.79 170.76 4.95 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.558 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.486 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.89 -14.21 43.81 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.358 2.039 . . . . 0.0 111.927 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.61 -31.61 72.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.383 . . . . 0.0 110.584 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.1 m -93.35 -20.49 20.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.007 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.12 -139.61 48.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.558 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.1 -14.6 55.91 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.99 21.0 6.1 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -66.5 -178.45 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.795 0.331 . . . . 0.0 110.869 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 m -152.57 53.25 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 30.6 m . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.871 -179.987 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.431 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.6 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.856 0.36 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -98.91 28.99 4.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.444 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.53 169.54 9.09 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.686 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.444 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 63.1 Cg_endo -70.59 -10.48 27.97 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.56 2.173 . . . . 0.0 111.868 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -84.01 -24.88 30.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.744 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.5 m -79.88 -29.13 39.89 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.92 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.94 28.67 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.884 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -24.52 7.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.672 0.272 . . . . 0.0 111.548 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.26 37.4 1.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.291 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.4 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -72.72 -178.23 2.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.869 179.921 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -144.94 47.13 1.34 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.786 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.8 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.885 -179.961 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.853 0.359 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.8 t -106.45 28.79 7.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.889 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.449 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.66 169.88 8.54 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.561 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.449 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.0 Cg_endo -70.1 -10.74 28.99 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.506 2.137 . . . . 0.0 111.816 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.99 -25.57 29.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.736 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.2 m -77.37 -29.56 53.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.899 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -145.1 30.86 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.889 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.27 -23.69 9.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.712 0.291 . . . . 0.0 111.617 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.27 1.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.352 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -178.39 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.896 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -147.02 47.12 1.16 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.8 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.97 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.854 0.359 . . . . 0.0 110.986 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -107.51 -23.55 12.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.933 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.479 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -55.17 168.28 0.57 Allowed Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.95 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.479 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 56.5 Cg_endo -68.58 -11.33 31.61 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.491 2.127 . . . . 0.0 111.911 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -62.31 -25.72 68.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.654 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -99.57 -25.64 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.432 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.03 -145.1 38.09 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.655 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.29 -25.01 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.51 38.4 1.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.569 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.432 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.11 -178.85 6.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.65 50.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.807 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.3 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.927 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.764 ' N ' ' HG ' ' A' ' 12' ' ' SER . 1.6 t . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -110.22 27.79 9.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.455 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.4 169.91 8.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.642 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.455 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.91 -10.85 29.42 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.452 2.101 . . . . 0.0 111.873 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -83.83 -25.74 30.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.763 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.5 m -76.06 -31.63 58.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.848 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.49 -140.41 33.19 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.781 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.06 -22.87 17.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.696 0.284 . . . . 0.0 111.508 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.95 35.14 1.28 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -75.22 -178.61 4.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.869 0.366 . . . . 0.0 110.877 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.764 ' HG ' ' N ' ' A' ' 2' ' ' CYS . 0.4 OUTLIER -152.49 47.54 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.792 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.5 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.886 -179.978 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.882 0.372 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -104.34 27.87 7.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.012 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.11 160.7 30.1 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 120.993 0.425 . . . . 0.0 111.17 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_exo -44.62 -26.91 2.01 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.061 2.508 . . . . 0.0 112.606 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -59.81 -32.08 70.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.971 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.57 -27.23 16.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.17 -149.4 9.54 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.749 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.71 -25.13 1.64 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.89 39.12 1.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.493 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.74 -179.46 6.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.863 0.363 . . . . 0.0 111.084 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -142.53 52.17 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.7 m . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.927 -179.998 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 18.7 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.794 0.331 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.4 t -116.81 27.15 9.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.124 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.49 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.81 4.96 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.452 179.673 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.49 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.323 2.015 . . . . 0.0 111.922 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -62.02 -31.52 71.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.639 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -96.03 -25.66 15.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.846 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.38 -142.14 47.0 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.549 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.47 -21.65 10.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.04 33.75 1.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.681 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.42 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -77.72 -178.59 5.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.854 0.359 . . . . 0.0 110.872 179.752 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -146.89 50.49 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.851 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.0 m . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.937 179.958 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.0 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.819 0.342 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.8 t -97.67 23.95 7.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.461 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.48 170.44 7.2 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.655 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.461 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.0 Cg_endo -69.56 -11.48 31.21 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.458 2.105 . . . . 0.0 111.829 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -69.37 -27.12 65.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.718 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -98.21 -21.51 16.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.993 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.45 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.38 -148.84 19.8 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.72 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.86 -23.93 1.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.15 36.88 0.98 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.671 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.45 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.7 OUTLIER -80.67 -178.4 6.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.709 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -132.84 47.39 2.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.9 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.865 ' N ' ' HG ' ' A' ' 12' ' ' SER . 6.2 p . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.78 0.324 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -113.71 29.89 7.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.484 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -112.43 169.2 6.61 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.682 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.484 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.6 Cg_endo -70.29 40.49 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.535 2.156 . . . . 0.0 112.236 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' A' ' 4' ' ' HIS . 59.4 mm-40 -120.16 -27.31 5.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.388 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -99.02 -6.0 29.36 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.22 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.39 -146.4 37.22 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.58 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.95 -15.44 43.47 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.12 24.06 3.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -62.0 -178.06 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.763 0.316 . . . . 0.0 110.796 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.865 ' HG ' ' N ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -148.17 76.61 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 11.7 p . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.796 0.332 . . . . 0.0 110.888 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.1 t -119.7 26.88 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.485 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.53 170.8 4.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.496 179.731 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.485 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.2 Cg_endo -64.91 -14.05 42.96 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.319 2.013 . . . . 0.0 111.953 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -62.15 -31.66 72.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.908 0.385 . . . . 0.0 110.609 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.99 -22.74 17.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.83 -139.05 48.62 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.501 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.8 -16.27 48.55 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.78 24.79 3.93 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -69.43 -178.53 1.41 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.809 0.338 . . . . 0.0 110.882 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -141.95 54.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.85 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.823 0.344 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.2 t -108.76 28.43 8.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.887 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.452 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.41 169.99 8.46 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.618 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.5 Cg_endo -69.93 -10.92 29.56 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.446 2.097 . . . . 0.0 111.814 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.88 -25.77 29.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.796 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.1 m -76.36 -29.85 57.36 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.9 -144.12 31.83 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.828 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.18 -22.92 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.676 0.274 . . . . 0.0 111.594 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.13 35.24 1.19 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.334 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.8 OUTLIER -70.71 -178.34 1.82 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.852 0.358 . . . . 0.0 110.87 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.49 47.04 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.798 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.8 m . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.829 -179.938 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 13.0 p . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.812 0.339 . . . . 0.0 110.875 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.6 t -114.62 26.77 9.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.11 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.494 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.85 4.93 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.502 179.602 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.494 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.345 2.03 . . . . 0.0 111.948 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -61.5 -31.36 71.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.864 0.364 . . . . 0.0 110.611 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.04 -25.02 15.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.911 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.51 -141.18 47.56 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.591 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.47 -21.13 14.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.63 0.252 . . . . 0.0 111.633 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.41 33.3 1.42 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.607 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.425 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.53 -178.5 4.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.828 0.346 . . . . 0.0 110.885 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -146.07 63.98 1.23 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.914 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.453 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 28.6 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.834 0.35 . . . . 0.0 110.989 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.6 t -121.64 28.18 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.922 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.484 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.9 170.64 5.06 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.517 179.737 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.93 -14.26 44.19 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.311 2.008 . . . . 0.0 111.945 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.18 -31.5 72.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.886 0.374 . . . . 0.0 110.565 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -91.28 -19.29 23.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.413 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 61.2 -140.96 47.92 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.493 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.78 -12.23 60.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.584 0.23 . . . . 0.0 111.615 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.86 12.67 16.61 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.413 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -60.51 -178.62 0.09 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 110.83 179.95 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.0 m -154.1 53.3 0.69 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.803 0.335 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -97.59 25.62 5.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.453 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.98 8.04 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.677 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.453 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.7 Cg_endo -70.56 -10.59 28.24 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.444 2.096 . . . . 0.0 111.811 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -73.11 -25.16 60.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.793 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.33 -28.17 14.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.855 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.435 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.51 -144.58 29.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.806 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.79 -26.3 1.57 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.89 39.51 1.04 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.487 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.435 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.53 -178.67 6.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.815 0.34 . . . . 0.0 110.928 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -143.48 49.98 1.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.882 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.898 -179.988 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.447 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 4.8 p . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.808 0.337 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.7 t -116.18 30.27 7.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.018 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.475 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -113.26 169.14 6.74 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.688 179.703 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.475 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -70.4 40.42 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.564 2.176 . . . . 0.0 112.165 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.42 ' H ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -120.17 -27.06 5.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.257 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -99.42 -11.36 21.2 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.216 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.428 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 58.42 -145.77 41.56 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.545 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -17.13 30.75 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.59 27.25 2.71 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.428 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -65.55 -178.11 0.5 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.793 0.33 . . . . 0.0 110.845 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.13 47.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.814 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.1 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.904 179.982 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.874 0.369 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t -106.44 28.58 7.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.883 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.445 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.68 169.89 8.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.604 179.956 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.98 -10.81 29.26 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.437 2.091 . . . . 0.0 111.881 179.715 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -83.65 -25.82 30.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.739 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.0 m -77.5 -29.43 52.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.963 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.85 -145.07 29.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.797 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.13 -23.79 8.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.644 0.259 . . . . 0.0 111.604 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.35 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.327 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -71.65 -178.35 2.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.888 179.88 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.97 47.18 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.907 -179.983 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.442 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.861 0.362 . . . . 0.0 110.887 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -104.44 27.9 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.958 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.442 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.09 160.71 30.01 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.97 0.414 . . . . 0.0 111.125 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.53 -27.03 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.146 2.564 . . . . 0.0 112.583 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -32.31 70.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.39 -27.24 16.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.901 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.08 -149.56 9.2 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.743 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.42 -25.23 1.54 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.9 39.27 1.07 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.488 -179.805 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.9 -179.41 6.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.86 0.362 . . . . 0.0 111.07 179.785 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.7 m -142.41 52.0 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.828 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.9 m . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.926 179.996 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.733 ' N ' ' HG ' ' A' ' 12' ' ' SER . 19.6 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.809 0.338 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.0 t -97.65 25.48 5.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.917 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.448 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.96 8.08 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.688 -179.945 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.448 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.6 Cg_endo -70.57 -10.49 28.02 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.454 2.103 . . . . 0.0 111.799 179.727 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 tm0? -73.03 -25.22 60.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.785 179.597 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.31 -27.86 14.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.841 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.436 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.53 29.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.747 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.58 -26.51 1.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.671 0.272 . . . . 0.0 111.68 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 39.68 1.04 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.522 -179.813 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.436 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.84 -178.63 6.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.888 179.811 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.733 ' HG ' ' N ' ' A' ' 2' ' ' CYS . 0.3 OUTLIER -144.95 56.9 1.27 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.932 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.4 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.878 -179.985 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.4 p . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.826 0.345 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.9 t -98.09 25.7 5.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.445 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.53 169.86 8.27 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.706 -179.966 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 64.5 Cg_endo -70.67 -10.92 28.81 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.529 2.153 . . . . 0.0 111.865 179.748 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.28 -24.61 60.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.77 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.35 -27.98 14.24 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.42 -145.01 28.25 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.828 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.27 -26.65 1.28 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -179.893 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.83 39.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.467 -179.848 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.94 -178.51 6.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.955 179.718 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.96 47.91 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.895 179.98 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.4 m . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.907 -179.978 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.2 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.795 0.331 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 t -97.11 25.98 5.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.013 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.438 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.8 169.13 8.94 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.678 179.995 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.438 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 66.9 Cg_endo -71.01 -9.9 26.53 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.443 2.095 . . . . 0.0 111.819 179.754 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mp0 -73.89 -24.06 59.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.881 179.65 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.65 -26.44 14.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.944 179.963 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.44 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.01 -143.25 25.82 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.825 179.741 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.19 -27.98 1.13 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.702 0.287 . . . . 0.0 111.679 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.34 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.332 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.44 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.59 -178.9 6.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.988 179.781 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 m -140.07 47.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.841 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.3 m . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.973 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.462 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 31.8 p . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.82 0.343 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -126.75 27.48 6.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.462 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.64 159.41 35.7 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 111.171 -179.985 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.29 -25.41 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 123.142 2.561 . . . . 0.0 112.763 -179.914 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -59.62 -26.98 65.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.101 -179.797 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.01 -22.1 15.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.051 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.21 -143.35 41.18 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.695 179.888 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.29 55.66 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -179.861 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.07 8.49 20.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.431 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -59.81 -178.76 0.08 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.858 0.361 . . . . 0.0 111.035 -179.946 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -144.49 47.44 1.37 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.813 179.911 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.921 179.985 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 1.6 t . . . . . 0 N--CA 1.458 -0.04 0 CA-C-O 120.834 0.35 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 t -117.62 28.84 8.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 179.804 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.471 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.43 171.33 6.32 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.382 179.828 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.471 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 56.4 Cg_endo -67.83 -11.66 32.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.383 2.055 . . . . 0.0 111.866 179.746 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -82.1 -29.36 31.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 110.787 179.638 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.6 -27.62 58.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.08 -146.51 23.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.966 179.696 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.78 -24.34 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.725 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.73 37.25 1.01 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.36 -179.976 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.402 ' HA ' ' O ' ' A' ' 2' ' ' CYS . 43.9 p90 -75.31 -174.12 2.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.858 0.361 . . . . 0.0 111.002 179.953 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -161.82 73.55 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.708 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.846 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 29.8 p . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.839 0.352 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -124.86 27.72 6.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.046 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.469 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -112.06 161.81 24.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.169 179.965 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -43.37 -25.99 0.87 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.27 2.647 . . . . 0.0 112.843 -179.891 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -59.64 -32.8 70.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -100.05 -29.13 12.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.9 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.77 -144.42 30.79 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.788 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.26 -26.93 1.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.1 40.33 1.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.467 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.64 -178.91 6.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.787 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -133.83 47.17 2.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.873 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.864 0.364 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -98.47 25.31 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.882 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.452 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.74 170.08 7.89 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.677 -179.975 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.4 Cg_endo -70.33 -10.8 28.91 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.453 2.102 . . . . 0.0 111.775 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -72.37 -25.81 61.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.758 179.599 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.0 -28.18 14.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.423 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.63 -144.47 30.08 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.819 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.87 -25.5 1.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.723 0.297 . . . . 0.0 111.728 -179.816 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 38.49 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.474 -179.828 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.423 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.14 -178.65 6.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 0.0 110.909 179.729 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -140.81 47.97 1.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.851 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.433 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.803 0.335 . . . . 0.0 110.855 . . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.4 t -116.37 27.93 8.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.063 -179.955 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 4' ' ' HIS . . . . . 0.446 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -114.02 169.49 6.47 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.616 179.746 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 5' ' ' PRO . . . . . 0.446 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 58.9 Cg_endo -69.4 41.86 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.545 2.163 . . . . 0.0 112.275 -179.899 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.412 ' H ' ' C ' ' A' ' 4' ' ' HIS . 6.8 mt-30 -120.28 -28.71 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.236 179.201 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.03 -23.16 14.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.031 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.15 -140.18 48.1 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.481 -179.911 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.39 -22.82 13.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.691 0.281 . . . . 0.0 111.558 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -95.67 35.76 1.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.528 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' TYR . . . . . 0.416 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.55 -178.7 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.909 179.766 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -130.71 53.38 1.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.886 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.83 0.347 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.0 t -146.82 72.61 1.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.883 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -97.19 25.87 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.017 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.428 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.69 169.1 9.0 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.639 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 67.6 Cg_endo -71.07 -9.68 26.06 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.45 2.1 . . . . 0.0 111.833 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -74.22 -23.79 59.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.863 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.71 -26.47 14.05 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.982 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.86 -143.11 25.33 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.837 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.11 -27.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.747 0.308 . . . . 0.0 111.698 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.41 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.33 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.439 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.81 -178.75 6.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.98 179.751 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.5 m -140.54 47.69 1.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.892 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.2 m -60.85 -35.74 77.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.934 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -160.01 -48.39 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.935 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.7 mttm . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.922 179.963 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.879 0.371 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 21.0 p -160.01 118.01 2.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.948 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -118.62 27.49 8.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.077 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.487 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.46 170.85 4.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.522 179.65 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 38.3 Cg_endo -64.66 -14.26 43.64 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.365 2.043 . . . . 0.0 111.91 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -62.31 -31.55 72.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.932 0.396 . . . . 0.0 110.604 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -22.74 17.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.926 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.1 -140.35 48.05 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.539 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -17.16 44.46 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.98 26.63 3.13 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -71.18 -178.52 2.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.797 0.332 . . . . 0.0 110.823 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.4 p -149.32 51.83 0.95 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.5 m -60.02 -67.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.94 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.96 81.13 0.71 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.935 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.3 mttt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.896 -179.992 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.847 0.356 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.425 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.4 t -141.42 54.12 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.847 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -98.44 28.75 3.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.448 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.75 169.43 9.17 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.448 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.1 Cg_endo -70.49 -10.58 28.28 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.488 2.125 . . . . 0.0 111.809 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.64 -25.16 31.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.765 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -80.04 -29.98 39.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.74 -144.54 26.26 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.881 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.2 -24.57 4.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.676 0.274 . . . . 0.0 111.666 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.24 37.25 1.04 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.442 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.94 -178.47 3.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 0.0 110.904 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.3 p -149.16 47.19 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.72 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m -67.94 -32.93 73.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.841 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -160.02 -67.55 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.831 0.348 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.42 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.3 t -135.51 54.07 1.94 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.928 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.2 t -98.44 28.78 3.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.926 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.446 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.77 169.47 9.1 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.668 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.446 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.5 Cg_endo -70.46 -10.65 28.45 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.475 2.117 . . . . 0.0 111.881 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -83.61 -25.12 31.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.774 179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.2 m -80.04 -29.91 39.36 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.75 -144.53 26.32 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.926 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.42 -24.38 4.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.722 0.296 . . . . 0.0 111.692 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.3 37.08 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.77 -178.47 3.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.858 179.87 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.1 p -149.14 47.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m -67.82 179.28 1.47 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.28 32.6 4.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.897 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.7 mttt . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.899 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.852 0.358 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.435 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.1 OUTLIER -144.51 49.54 1.32 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.811 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -110.77 29.77 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.244 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.435 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -118.44 157.83 48.43 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.907 0.384 . . . . 0.0 111.024 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -43.92 -25.59 1.11 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.169 2.579 . . . . 0.0 113.014 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -59.54 -47.53 85.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.834 0.349 . . . . 0.0 111.061 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 m -77.86 -28.4 50.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.005 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 51.82 -139.44 28.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.897 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.22 -27.95 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.763 0.316 . . . . 0.0 111.579 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.55 41.85 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 1.0 OUTLIER -77.6 -178.07 5.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.952 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -150.91 47.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.8 m -62.3 135.18 57.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.01 -65.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.924 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.0 mttp . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.901 179.964 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 26.2 mmt-85 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.844 0.354 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.476 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 23.2 p -121.61 120.31 34.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.971 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 30.7 t -121.0 27.64 8.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.486 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.79 170.76 4.95 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.558 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.486 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.89 -14.21 43.81 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.358 2.039 . . . . 0.0 111.927 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.61 -31.61 72.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.383 . . . . 0.0 110.584 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.1 m -93.35 -20.49 20.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.007 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.12 -139.61 48.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.558 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.1 -14.6 55.91 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.99 21.0 6.1 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -66.5 -178.45 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.795 0.331 . . . . 0.0 110.869 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 m -152.57 53.25 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 30.6 m -60.05 107.66 0.66 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.871 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -135.28 -48.16 0.71 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.925 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.5 mttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.875 179.958 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.2 mtm180 . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.856 0.36 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.431 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.6 t -153.68 55.8 0.74 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.881 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -98.91 28.99 4.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.444 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.53 169.54 9.09 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.686 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.444 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 63.1 Cg_endo -70.59 -10.48 27.97 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.56 2.173 . . . . 0.0 111.868 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -84.01 -24.88 30.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.744 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.5 m -79.88 -29.13 39.89 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.92 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.94 28.67 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.884 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -24.52 7.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.672 0.272 . . . . 0.0 111.548 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.26 37.4 1.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.291 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.4 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -72.72 -178.23 2.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.869 179.921 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -144.94 47.13 1.34 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.786 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.8 m -69.8 -173.83 0.67 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.885 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -101.07 31.87 3.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.878 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.906 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.837 0.351 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t -152.74 66.49 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.8 t -106.45 28.79 7.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.889 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.449 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.66 169.88 8.54 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.561 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.449 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.0 Cg_endo -70.1 -10.74 28.99 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.506 2.137 . . . . 0.0 111.816 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.99 -25.57 29.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.736 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.2 m -77.37 -29.56 53.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.899 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -145.1 30.86 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.889 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.27 -23.69 9.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.712 0.291 . . . . 0.0 111.617 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.27 1.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.352 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -178.39 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.896 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -147.02 47.12 1.16 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.8 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m -69.52 -66.31 0.6 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -159.46 -69.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.895 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.9 pttm . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.918 179.963 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.3 mmp_? . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.797 0.332 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 28.2 p -128.67 113.86 15.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.986 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -107.51 -23.55 12.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.933 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.479 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -55.17 168.28 0.57 Allowed Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.95 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.479 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 56.5 Cg_endo -68.58 -11.33 31.61 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.491 2.127 . . . . 0.0 111.911 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -62.31 -25.72 68.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.654 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -99.57 -25.64 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.432 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.03 -145.1 38.09 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.655 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.29 -25.01 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.51 38.4 1.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.569 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.432 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.11 -178.85 6.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.65 50.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.807 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.3 m -59.99 -169.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.927 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.29 36.96 1.51 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.858 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.936 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.0 ptt-85 . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.779 0.323 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t -132.81 71.46 1.47 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.919 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -110.22 27.79 9.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.455 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.4 169.91 8.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.642 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.455 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.91 -10.85 29.42 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.452 2.101 . . . . 0.0 111.873 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -83.83 -25.74 30.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.763 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.5 m -76.06 -31.63 58.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.848 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.49 -140.41 33.19 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.781 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.06 -22.87 17.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.696 0.284 . . . . 0.0 111.508 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.95 35.14 1.28 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -75.22 -178.61 4.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.869 0.366 . . . . 0.0 110.877 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.49 47.54 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.792 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.5 m -65.72 -66.9 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.886 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -152.58 -61.87 0.16 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 71.9 mttt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.917 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.86 0.362 . . . . 0.0 111.134 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -145.61 53.32 1.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -104.34 27.87 7.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.012 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.11 160.7 30.1 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 120.993 0.425 . . . . 0.0 111.17 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_exo -44.62 -26.91 2.01 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.061 2.508 . . . . 0.0 112.606 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -59.81 -32.08 70.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.971 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.57 -27.23 16.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.17 -149.4 9.54 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.749 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.71 -25.13 1.64 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.89 39.12 1.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.493 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.74 -179.46 6.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.863 0.363 . . . . 0.0 111.084 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -142.53 52.17 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.7 m -59.96 158.48 10.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.927 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.96 33.44 0.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.927 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.1 pttp . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.956 179.987 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 31.8 mtt85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.784 0.326 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 18.7 p -150.15 116.47 5.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.95 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.4 t -116.81 27.15 9.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.124 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.49 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.81 4.96 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.452 179.673 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.49 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.323 2.015 . . . . 0.0 111.922 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -62.02 -31.52 71.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.639 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -96.03 -25.66 15.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.846 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.38 -142.14 47.0 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.549 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.47 -21.65 10.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.04 33.75 1.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.681 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.42 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -77.72 -178.59 5.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.854 0.359 . . . . 0.0 110.872 179.752 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -146.89 50.49 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.851 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.0 m -59.98 -31.38 69.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.937 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -132.83 35.51 3.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.946 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.901 -179.995 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.1 mtp85 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.861 0.362 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.0 p -160.03 98.68 1.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.016 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.8 t -97.67 23.95 7.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.461 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.48 170.44 7.2 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.655 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.461 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.0 Cg_endo -69.56 -11.48 31.21 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.458 2.105 . . . . 0.0 111.829 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -69.37 -27.12 65.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.718 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -98.21 -21.51 16.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.993 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.45 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.38 -148.84 19.8 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.72 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.86 -23.93 1.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.15 36.88 0.98 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.671 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.45 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.7 OUTLIER -80.67 -178.4 6.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.709 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -132.84 47.39 2.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.94 -167.8 1.55 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.9 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.3 mtm105 -79.97 92.89 5.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.922 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.865 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.7 ttt85 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.781 0.324 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.444 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 6.2 p -145.69 108.95 4.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.893 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -113.71 29.89 7.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.484 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -112.43 169.2 6.61 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.682 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.484 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.6 Cg_endo -70.29 40.49 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.535 2.156 . . . . 0.0 112.236 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' A' ' 4' ' ' HIS . 59.4 mm-40 -120.16 -27.31 5.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.388 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -99.02 -6.0 29.36 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.22 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.39 -146.4 37.22 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.58 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.95 -15.44 43.47 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.12 24.06 3.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -62.0 -178.06 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.763 0.316 . . . . 0.0 110.796 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.17 76.61 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.08 175.19 7.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.99 -51.53 8.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.91 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 20.3 mttp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.899 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.8 mtp180 . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.876 0.37 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 11.7 p -113.36 121.41 44.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.1 t -119.7 26.88 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.485 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.53 170.8 4.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.496 179.731 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.485 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.2 Cg_endo -64.91 -14.05 42.96 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.319 2.013 . . . . 0.0 111.953 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -62.15 -31.66 72.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.908 0.385 . . . . 0.0 110.609 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.99 -22.74 17.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.83 -139.05 48.62 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.501 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.8 -16.27 48.55 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.78 24.79 3.93 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -69.43 -178.53 1.41 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.809 0.338 . . . . 0.0 110.882 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -141.95 54.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.45 -34.17 15.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.85 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.98 -67.57 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.877 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.918 -179.997 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.846 0.355 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t -155.5 69.77 0.7 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.2 t -108.76 28.43 8.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.887 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.452 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.41 169.99 8.46 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.618 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.5 Cg_endo -69.93 -10.92 29.56 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.446 2.097 . . . . 0.0 111.814 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.88 -25.77 29.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.796 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.1 m -76.36 -29.85 57.36 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.9 -144.12 31.83 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.828 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.18 -22.92 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.676 0.274 . . . . 0.0 111.594 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.13 35.24 1.19 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.334 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.8 OUTLIER -70.71 -178.34 1.82 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.852 0.358 . . . . 0.0 110.87 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.49 47.04 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.798 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.8 m -69.67 -35.44 75.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.829 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -160.02 147.6 16.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.868 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 42.1 mttm . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.908 -179.989 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.77 0.319 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 13.0 p -144.78 115.17 7.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.6 t -114.62 26.77 9.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.11 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.494 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.85 4.93 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.502 179.602 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.494 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.345 2.03 . . . . 0.0 111.948 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -61.5 -31.36 71.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.864 0.364 . . . . 0.0 110.611 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.04 -25.02 15.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.911 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.51 -141.18 47.56 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.591 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.47 -21.13 14.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.63 0.252 . . . . 0.0 111.633 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.41 33.3 1.42 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.607 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.425 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.53 -178.5 4.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.828 0.346 . . . . 0.0 110.885 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -146.07 63.98 1.23 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.914 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.61 129.45 34.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.902 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.56 -51.97 3.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.878 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.3 mttt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.888 179.996 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.77 0.319 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.453 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 28.6 p -95.82 117.38 30.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.989 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.6 t -121.64 28.18 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.922 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.484 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.9 170.64 5.06 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.517 179.737 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.93 -14.26 44.19 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.311 2.008 . . . . 0.0 111.945 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.18 -31.5 72.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.886 0.374 . . . . 0.0 110.565 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -91.28 -19.29 23.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.413 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 61.2 -140.96 47.92 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.493 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.78 -12.23 60.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.584 0.23 . . . . 0.0 111.615 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.86 12.67 16.61 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.413 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -60.51 -178.62 0.09 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 110.83 179.95 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.0 m -154.1 53.3 0.69 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -66.12 146.85 54.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 ptt85 -108.14 -39.56 5.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.885 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.877 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.769 0.319 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -160.0 97.5 1.28 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.92 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -97.59 25.62 5.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.453 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.98 8.04 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.677 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.453 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.7 Cg_endo -70.56 -10.59 28.24 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.444 2.096 . . . . 0.0 111.811 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -73.11 -25.16 60.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.793 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.33 -28.17 14.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.855 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.435 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.51 -144.58 29.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.806 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.79 -26.3 1.57 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.89 39.51 1.04 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.487 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.435 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.53 -178.67 6.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.815 0.34 . . . . 0.0 110.928 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -143.48 49.98 1.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.882 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 m -61.58 85.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.8 mmm-85 -106.84 88.77 2.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.6 mttm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.911 -179.99 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.825 0.345 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.447 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 4.8 p -149.23 113.07 5.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.924 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.7 t -116.18 30.27 7.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.018 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.475 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -113.26 169.14 6.74 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.688 179.703 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.475 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -70.4 40.42 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.564 2.176 . . . . 0.0 112.165 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.42 ' H ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -120.17 -27.06 5.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.257 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -99.42 -11.36 21.2 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.216 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.428 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 58.42 -145.77 41.56 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.545 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -17.13 30.75 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.59 27.25 2.71 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.428 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -65.55 -178.11 0.5 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.793 0.33 . . . . 0.0 110.845 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.13 47.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.814 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.1 m -61.35 85.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.904 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -114.07 -65.45 1.19 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.899 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.902 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.1 ttp85 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.923 0.392 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t -143.83 66.04 1.3 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.887 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t -106.44 28.58 7.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.883 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.445 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.68 169.89 8.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.604 179.956 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.98 -10.81 29.26 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.437 2.091 . . . . 0.0 111.881 179.715 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -83.65 -25.82 30.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.739 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.0 m -77.5 -29.43 52.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.963 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.85 -145.07 29.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.797 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.13 -23.79 8.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.644 0.259 . . . . 0.0 111.604 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.35 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.327 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -71.65 -178.35 2.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.888 179.88 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.97 47.18 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m -69.44 154.08 42.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.94 152.47 21.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.867 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.6 mttt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.897 179.969 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.4 tpp180 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.861 0.362 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.442 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -140.19 53.32 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.887 179.959 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -104.44 27.9 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.958 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.442 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.09 160.71 30.01 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.97 0.414 . . . . 0.0 111.125 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.53 -27.03 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.146 2.564 . . . . 0.0 112.583 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -32.31 70.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.39 -27.24 16.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.901 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.08 -149.56 9.2 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.743 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.42 -25.23 1.54 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.9 39.27 1.07 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.488 -179.805 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.9 -179.41 6.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.86 0.362 . . . . 0.0 111.07 179.785 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.7 m -142.41 52.0 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.828 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.9 m -59.97 -31.61 70.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.926 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.07 35.38 4.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.899 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 pttt . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.895 179.974 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.838 0.351 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -159.99 97.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.882 -179.992 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.0 t -97.65 25.48 5.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.917 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.448 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.96 8.08 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.688 -179.945 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.448 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.6 Cg_endo -70.57 -10.49 28.02 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.454 2.103 . . . . 0.0 111.799 179.727 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 tm0? -73.03 -25.22 60.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.785 179.597 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.31 -27.86 14.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.841 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.436 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.53 29.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.747 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.58 -26.51 1.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.671 0.272 . . . . 0.0 111.68 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 39.68 1.04 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.522 -179.813 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.436 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.84 -178.63 6.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.888 179.811 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -144.95 56.9 1.27 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.4 m -69.28 94.16 0.68 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.878 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -134.65 -66.49 0.6 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.873 179.988 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.8 pttt . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.854 -179.982 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.793 0.33 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.4 p -159.76 98.16 1.34 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.002 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.9 t -98.09 25.7 5.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.445 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.53 169.86 8.27 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.706 -179.966 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 64.5 Cg_endo -70.67 -10.92 28.81 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.529 2.153 . . . . 0.0 111.865 179.748 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.28 -24.61 60.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.77 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.35 -27.98 14.24 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.42 -145.01 28.25 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.828 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.27 -26.65 1.28 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -179.893 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.83 39.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.467 -179.848 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.94 -178.51 6.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.955 179.718 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.96 47.91 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.895 179.98 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.4 m -60.0 119.07 7.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.907 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -147.81 -58.03 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.917 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 93.5 mtm-85 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.846 0.355 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.2 t -146.88 72.66 1.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 t -97.11 25.98 5.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.013 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.438 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.8 169.13 8.94 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.678 179.995 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.438 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 66.9 Cg_endo -71.01 -9.9 26.53 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.443 2.095 . . . . 0.0 111.819 179.754 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mp0 -73.89 -24.06 59.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.881 179.65 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.65 -26.44 14.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.944 179.963 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.44 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.01 -143.25 25.82 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.825 179.741 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.19 -27.98 1.13 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.702 0.287 . . . . 0.0 111.679 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.34 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.332 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.44 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.59 -178.9 6.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.988 179.781 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 m -140.07 47.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.841 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.3 m -60.7 -67.31 0.41 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -131.74 -173.12 3.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.884 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.3 mttp . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.907 179.993 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.823 0.344 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.462 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 31.8 p -112.95 120.93 43.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -126.75 27.48 6.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.462 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.64 159.41 35.7 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 111.171 -179.985 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.29 -25.41 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 123.142 2.561 . . . . 0.0 112.763 -179.914 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -59.62 -26.98 65.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.101 -179.797 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.01 -22.1 15.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.051 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.21 -143.35 41.18 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.695 179.888 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.29 55.66 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -179.861 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.07 8.49 20.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.431 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -59.81 -178.76 0.08 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.858 0.361 . . . . 0.0 111.035 -179.946 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -144.49 47.44 1.37 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.813 179.911 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.27 -169.62 0.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.921 179.985 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.09 31.2 1.77 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.895 -179.979 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.8 mtpm? . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.856 -179.991 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.837 0.351 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 1.6 t -146.01 76.26 1.45 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.903 -179.978 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 t -117.62 28.84 8.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 179.804 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.471 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.43 171.33 6.32 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.382 179.828 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.471 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 56.4 Cg_endo -67.83 -11.66 32.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.383 2.055 . . . . 0.0 111.866 179.746 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -82.1 -29.36 31.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 110.787 179.638 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.6 -27.62 58.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.08 -146.51 23.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.966 179.696 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.78 -24.34 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.725 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.73 37.25 1.01 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.36 -179.976 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.402 ' HA ' ' O ' ' A' ' 2' ' ' CYS . 43.9 p90 -75.31 -174.12 2.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.858 0.361 . . . . 0.0 111.002 179.953 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -161.82 73.55 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.708 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 -169.39 2.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.846 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 tpt85 -149.54 79.47 1.39 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 -179.99 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.852 0.358 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 29.8 p -159.98 117.76 2.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.901 -179.998 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -124.86 27.72 6.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.046 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.469 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -112.06 161.81 24.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.169 179.965 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -43.37 -25.99 0.87 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.27 2.647 . . . . 0.0 112.843 -179.891 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -59.64 -32.8 70.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -100.05 -29.13 12.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.9 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.77 -144.42 30.79 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.788 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.26 -26.93 1.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.1 40.33 1.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.467 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.64 -178.91 6.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.787 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -133.83 47.17 2.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.08 -169.25 0.89 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.873 -179.99 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.89 79.6 9.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 179.992 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.2 mtmt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.934 179.995 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.9 0.381 . . . . 0.0 111.184 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -140.32 97.84 3.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.904 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -98.47 25.31 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.882 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.452 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.74 170.08 7.89 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.677 -179.975 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.4 Cg_endo -70.33 -10.8 28.91 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.453 2.102 . . . . 0.0 111.775 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -72.37 -25.81 61.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.758 179.599 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.0 -28.18 14.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.423 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.63 -144.47 30.08 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.819 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.87 -25.5 1.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.723 0.297 . . . . 0.0 111.728 -179.816 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 38.49 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.474 -179.828 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.423 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.14 -178.65 6.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 0.0 110.909 179.729 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -140.81 47.97 1.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.851 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.57 -33.53 74.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.901 179.977 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -153.38 79.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.947 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.874 -179.942 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.792 0.33 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.433 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.9 OUTLIER -80.09 78.75 6.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.855 -179.991 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.4 t -116.37 27.93 8.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.063 -179.955 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.446 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -114.02 169.49 6.47 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.616 179.746 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.446 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 58.9 Cg_endo -69.4 41.86 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.545 2.163 . . . . 0.0 112.275 -179.899 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.412 ' H ' ' C ' ' A' ' 4' ' ' HIS . 6.8 mt-30 -120.28 -28.71 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.236 179.201 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.03 -23.16 14.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.031 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.15 -140.18 48.1 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.481 -179.911 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.39 -22.82 13.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.691 0.281 . . . . 0.0 111.558 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -95.67 35.76 1.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.528 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' TYR . . . . . 0.416 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.55 -178.7 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.909 179.766 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -130.71 53.38 1.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.886 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.02 -31.57 8.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -119.85 -45.34 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.932 179.995 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.7 mtmt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.905 179.991 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.0 t . . . . . 0 C--O 1.23 0.067 0 CA-C-O 120.813 0.339 . . . . 0.0 110.883 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -97.19 25.87 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.017 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.428 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.69 169.1 9.0 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.639 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 67.6 Cg_endo -71.07 -9.68 26.06 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.45 2.1 . . . . 0.0 111.833 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -74.22 -23.79 59.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.863 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.71 -26.47 14.05 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.982 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.86 -143.11 25.33 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.837 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.11 -27.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.747 0.308 . . . . 0.0 111.698 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.41 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.33 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.439 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.81 -178.75 6.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.98 179.751 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.5 m -140.54 47.69 1.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.892 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.2 m . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.934 179.999 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 21.0 p . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.783 0.325 . . . . 0.0 110.948 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -118.62 27.49 8.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.077 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.487 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.46 170.85 4.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.522 179.65 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 38.3 Cg_endo -64.66 -14.26 43.64 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.365 2.043 . . . . 0.0 111.91 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -62.31 -31.55 72.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.932 0.396 . . . . 0.0 110.604 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -22.74 17.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.926 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.1 -140.35 48.05 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.539 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -17.16 44.46 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.98 26.63 3.13 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -71.18 -178.52 2.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.797 0.332 . . . . 0.0 110.823 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.4 p -149.32 51.83 0.95 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.5 m . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.94 179.957 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.688 ' N ' ' HG ' ' A' ' 12' ' ' SER . 1.4 t . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.859 0.361 . . . . 0.0 110.847 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -98.44 28.75 3.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.448 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.75 169.43 9.17 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.448 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.1 Cg_endo -70.49 -10.58 28.28 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.488 2.125 . . . . 0.0 111.809 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.64 -25.16 31.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.765 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -80.04 -29.98 39.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.74 -144.54 26.26 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.881 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.2 -24.57 4.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.676 0.274 . . . . 0.0 111.666 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.24 37.25 1.04 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.442 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.94 -178.47 3.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 0.0 110.904 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.688 ' HG ' ' N ' ' A' ' 2' ' ' CYS . 12.3 p -149.16 47.19 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.72 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m . . . . . 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.841 -179.902 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.678 ' N ' ' HG ' ' A' ' 12' ' ' SER . 1.3 t . . . . . 0 C--O 1.231 0.118 0 CA-C-O 120.908 0.385 . . . . 0.0 110.928 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.2 t -98.44 28.78 3.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.926 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.446 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.77 169.47 9.1 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.668 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.446 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.5 Cg_endo -70.46 -10.65 28.45 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.475 2.117 . . . . 0.0 111.881 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -83.61 -25.12 31.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.774 179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.2 m -80.04 -29.91 39.36 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.75 -144.53 26.32 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.926 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.42 -24.38 4.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.722 0.296 . . . . 0.0 111.692 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.3 37.08 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.77 -178.47 3.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.858 179.87 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.678 ' HG ' ' N ' ' A' ' 2' ' ' CYS . 12.1 p -149.14 47.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 -179.934 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.435 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.928 0.394 . . . . 0.0 110.811 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -110.77 29.77 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.244 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.435 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -118.44 157.83 48.43 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.907 0.384 . . . . 0.0 111.024 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -43.92 -25.59 1.11 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.169 2.579 . . . . 0.0 113.014 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -59.54 -47.53 85.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.834 0.349 . . . . 0.0 111.061 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 m -77.86 -28.4 50.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.005 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 51.82 -139.44 28.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.897 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.22 -27.95 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.763 0.316 . . . . 0.0 111.579 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.55 41.85 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 1.0 OUTLIER -77.6 -178.07 5.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.952 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -150.91 47.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.8 m . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.999 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.476 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 23.2 p . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.855 0.36 . . . . 0.0 110.971 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 30.7 t -121.0 27.64 8.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.486 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.79 170.76 4.95 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.558 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.486 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.89 -14.21 43.81 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.358 2.039 . . . . 0.0 111.927 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.61 -31.61 72.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.383 . . . . 0.0 110.584 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.1 m -93.35 -20.49 20.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.007 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.12 -139.61 48.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.558 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.1 -14.6 55.91 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.99 21.0 6.1 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -66.5 -178.45 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.795 0.331 . . . . 0.0 110.869 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 m -152.57 53.25 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 30.6 m . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.871 -179.987 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.431 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.6 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.856 0.36 . . . . 0.0 110.881 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -98.91 28.99 4.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.444 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.53 169.54 9.09 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.686 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.444 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 63.1 Cg_endo -70.59 -10.48 27.97 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.56 2.173 . . . . 0.0 111.868 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -84.01 -24.88 30.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.744 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.5 m -79.88 -29.13 39.89 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.92 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.94 28.67 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.884 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -24.52 7.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.672 0.272 . . . . 0.0 111.548 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.26 37.4 1.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.291 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.4 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -72.72 -178.23 2.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.869 179.921 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -144.94 47.13 1.34 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.786 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.8 m . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.885 -179.961 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.853 0.359 . . . . 0.0 110.873 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.8 t -106.45 28.79 7.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.889 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.449 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.66 169.88 8.54 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.561 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.449 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.0 Cg_endo -70.1 -10.74 28.99 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.506 2.137 . . . . 0.0 111.816 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.99 -25.57 29.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.736 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.2 m -77.37 -29.56 53.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.899 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -145.1 30.86 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.889 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.27 -23.69 9.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.712 0.291 . . . . 0.0 111.617 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.27 1.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.352 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -178.39 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.896 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -147.02 47.12 1.16 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.8 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m . . . . . 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.97 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.454 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 28.2 p . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.854 0.359 . . . . 0.0 110.986 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -107.51 -23.55 12.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.933 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.479 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -55.17 168.28 0.57 Allowed Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.95 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.479 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 56.5 Cg_endo -68.58 -11.33 31.61 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.491 2.127 . . . . 0.0 111.911 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -62.31 -25.72 68.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.654 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -99.57 -25.64 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.432 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.03 -145.1 38.09 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.655 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.29 -25.01 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.51 38.4 1.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.569 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.432 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.11 -178.85 6.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.65 50.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.807 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.3 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.927 179.986 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.764 ' N ' ' HG ' ' A' ' 12' ' ' SER . 1.6 t . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.827 0.346 . . . . 0.0 110.919 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -110.22 27.79 9.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.455 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.4 169.91 8.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.642 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.455 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.91 -10.85 29.42 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.452 2.101 . . . . 0.0 111.873 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -83.83 -25.74 30.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.763 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.5 m -76.06 -31.63 58.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.848 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.49 -140.41 33.19 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.781 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.06 -22.87 17.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.696 0.284 . . . . 0.0 111.508 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.95 35.14 1.28 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -75.22 -178.61 4.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.869 0.366 . . . . 0.0 110.877 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.764 ' HG ' ' N ' ' A' ' 2' ' ' CYS . 0.4 OUTLIER -152.49 47.54 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.792 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.5 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.886 -179.978 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.882 0.372 . . . . 0.0 110.894 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -104.34 27.87 7.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.012 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.11 160.7 30.1 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 120.993 0.425 . . . . 0.0 111.17 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_exo -44.62 -26.91 2.01 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.061 2.508 . . . . 0.0 112.606 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -59.81 -32.08 70.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.971 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.57 -27.23 16.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.17 -149.4 9.54 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.749 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.71 -25.13 1.64 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.89 39.12 1.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.493 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.74 -179.46 6.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.863 0.363 . . . . 0.0 111.084 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -142.53 52.17 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.7 m . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.927 -179.998 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 18.7 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.794 0.331 . . . . 0.0 110.95 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.4 t -116.81 27.15 9.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.124 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.49 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.81 4.96 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.452 179.673 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.49 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.323 2.015 . . . . 0.0 111.922 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -62.02 -31.52 71.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.639 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -96.03 -25.66 15.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.846 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.38 -142.14 47.0 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.549 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.47 -21.65 10.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.04 33.75 1.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.681 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.42 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -77.72 -178.59 5.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.854 0.359 . . . . 0.0 110.872 179.752 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -146.89 50.49 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.851 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.0 m . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.937 179.958 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.0 p . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.819 0.342 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.8 t -97.67 23.95 7.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.461 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.48 170.44 7.2 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.655 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.461 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.0 Cg_endo -69.56 -11.48 31.21 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.458 2.105 . . . . 0.0 111.829 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -69.37 -27.12 65.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.718 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -98.21 -21.51 16.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.993 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.45 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.38 -148.84 19.8 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.72 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.86 -23.93 1.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.15 36.88 0.98 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.671 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.45 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.7 OUTLIER -80.67 -178.4 6.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.709 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -132.84 47.39 2.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.9 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.865 ' N ' ' HG ' ' A' ' 12' ' ' SER . 6.2 p . . . . . 0 C--O 1.231 0.105 0 CA-C-O 120.78 0.324 . . . . 0.0 110.893 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -113.71 29.89 7.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.484 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -112.43 169.2 6.61 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.682 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.484 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.6 Cg_endo -70.29 40.49 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.535 2.156 . . . . 0.0 112.236 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' A' ' 4' ' ' HIS . 59.4 mm-40 -120.16 -27.31 5.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.388 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -99.02 -6.0 29.36 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.22 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.39 -146.4 37.22 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.58 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.95 -15.44 43.47 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.12 24.06 3.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -62.0 -178.06 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.763 0.316 . . . . 0.0 110.796 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.865 ' HG ' ' N ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -148.17 76.61 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.919 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 11.7 p . . . . . 0 C--O 1.231 0.115 0 CA-C-O 120.796 0.332 . . . . 0.0 110.888 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.1 t -119.7 26.88 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.485 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.53 170.8 4.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.496 179.731 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.485 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.2 Cg_endo -64.91 -14.05 42.96 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.319 2.013 . . . . 0.0 111.953 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -62.15 -31.66 72.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.908 0.385 . . . . 0.0 110.609 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.99 -22.74 17.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.83 -139.05 48.62 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.501 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.8 -16.27 48.55 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.78 24.79 3.93 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -69.43 -178.53 1.41 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.809 0.338 . . . . 0.0 110.882 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -141.95 54.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.85 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.823 0.344 . . . . 0.0 110.859 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.2 t -108.76 28.43 8.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.887 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.452 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.41 169.99 8.46 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.618 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.5 Cg_endo -69.93 -10.92 29.56 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.446 2.097 . . . . 0.0 111.814 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.88 -25.77 29.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.796 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.1 m -76.36 -29.85 57.36 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.9 -144.12 31.83 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.828 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.18 -22.92 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.676 0.274 . . . . 0.0 111.594 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.13 35.24 1.19 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.334 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.8 OUTLIER -70.71 -178.34 1.82 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.852 0.358 . . . . 0.0 110.87 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.49 47.04 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.798 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.8 m . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.829 -179.938 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 13.0 p . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.812 0.339 . . . . 0.0 110.875 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.6 t -114.62 26.77 9.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.11 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.494 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.85 4.93 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.502 179.602 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.494 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.345 2.03 . . . . 0.0 111.948 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -61.5 -31.36 71.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.864 0.364 . . . . 0.0 110.611 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.04 -25.02 15.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.911 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.51 -141.18 47.56 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.591 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.47 -21.13 14.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.63 0.252 . . . . 0.0 111.633 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.41 33.3 1.42 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.607 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.425 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.53 -178.5 4.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.828 0.346 . . . . 0.0 110.885 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -146.07 63.98 1.23 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.914 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.902 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.453 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 28.6 p . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.834 0.35 . . . . 0.0 110.989 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.6 t -121.64 28.18 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.922 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.484 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.9 170.64 5.06 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.517 179.737 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.93 -14.26 44.19 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.311 2.008 . . . . 0.0 111.945 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.18 -31.5 72.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.886 0.374 . . . . 0.0 110.565 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -91.28 -19.29 23.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.413 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 61.2 -140.96 47.92 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.493 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.78 -12.23 60.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.584 0.23 . . . . 0.0 111.615 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.86 12.67 16.61 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.413 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -60.51 -178.62 0.09 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 110.83 179.95 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.0 m -154.1 53.3 0.69 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.803 0.335 . . . . 0.0 110.92 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -97.59 25.62 5.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.453 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.98 8.04 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.677 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.453 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.7 Cg_endo -70.56 -10.59 28.24 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.444 2.096 . . . . 0.0 111.811 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -73.11 -25.16 60.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.793 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.33 -28.17 14.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.855 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.435 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.51 -144.58 29.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.806 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.79 -26.3 1.57 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.89 39.51 1.04 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.487 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.435 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.53 -178.67 6.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.815 0.34 . . . . 0.0 110.928 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -143.48 49.98 1.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.882 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 m . . . . . 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.898 -179.988 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.447 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 4.8 p . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.808 0.337 . . . . 0.0 110.924 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.7 t -116.18 30.27 7.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.018 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.475 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -113.26 169.14 6.74 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.688 179.703 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.475 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -70.4 40.42 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.564 2.176 . . . . 0.0 112.165 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.42 ' H ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -120.17 -27.06 5.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.257 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -99.42 -11.36 21.2 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.216 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.428 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 58.42 -145.77 41.56 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.545 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -17.13 30.75 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.59 27.25 2.71 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.428 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -65.55 -178.11 0.5 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.793 0.33 . . . . 0.0 110.845 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.13 47.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.814 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.1 m . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.904 179.982 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.874 0.369 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t -106.44 28.58 7.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.883 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.445 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.68 169.89 8.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.604 179.956 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.98 -10.81 29.26 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.437 2.091 . . . . 0.0 111.881 179.715 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -83.65 -25.82 30.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.739 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.0 m -77.5 -29.43 52.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.963 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.85 -145.07 29.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.797 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.13 -23.79 8.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.644 0.259 . . . . 0.0 111.604 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.35 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.327 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -71.65 -178.35 2.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.888 179.88 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.97 47.18 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.907 -179.983 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.442 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.099 0 CA-C-O 120.861 0.362 . . . . 0.0 110.887 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -104.44 27.9 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.958 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.442 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.09 160.71 30.01 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.97 0.414 . . . . 0.0 111.125 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.53 -27.03 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.146 2.564 . . . . 0.0 112.583 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -32.31 70.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.39 -27.24 16.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.08 -149.56 9.2 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.743 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.42 -25.23 1.54 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.9 39.27 1.07 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.488 -179.805 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.9 -179.41 6.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.86 0.362 . . . . 0.0 111.07 179.785 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.7 m -142.41 52.0 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.828 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.9 m . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.926 179.996 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.733 ' N ' ' HG ' ' A' ' 12' ' ' SER . 19.6 p . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.809 0.338 . . . . 0.0 110.882 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.0 t -97.65 25.48 5.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.917 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.448 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.96 8.08 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.688 -179.945 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.448 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.6 Cg_endo -70.57 -10.49 28.02 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.454 2.103 . . . . 0.0 111.799 179.727 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 tm0? -73.03 -25.22 60.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.785 179.597 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.31 -27.86 14.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.841 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.436 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.53 29.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.747 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.58 -26.51 1.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.671 0.272 . . . . 0.0 111.68 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 39.68 1.04 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.522 -179.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.436 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.84 -178.63 6.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.888 179.811 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.733 ' HG ' ' N ' ' A' ' 2' ' ' CYS . 0.3 OUTLIER -144.95 56.9 1.27 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.932 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.4 m . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.878 -179.985 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.4 p . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.826 0.345 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.9 t -98.09 25.7 5.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.445 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.53 169.86 8.27 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.706 -179.966 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 64.5 Cg_endo -70.67 -10.92 28.81 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.529 2.153 . . . . 0.0 111.865 179.748 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.28 -24.61 60.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.77 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.35 -27.98 14.24 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.42 -145.01 28.25 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.828 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.27 -26.65 1.28 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -179.893 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.83 39.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.467 -179.848 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.94 -178.51 6.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.955 179.718 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.96 47.91 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.895 179.98 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.4 m . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.907 -179.978 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.2 t . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.795 0.331 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 t -97.11 25.98 5.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.013 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.438 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.8 169.13 8.94 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.678 179.995 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.438 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 66.9 Cg_endo -71.01 -9.9 26.53 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.443 2.095 . . . . 0.0 111.819 179.754 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mp0 -73.89 -24.06 59.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.881 179.65 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.65 -26.44 14.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.944 179.963 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.44 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.01 -143.25 25.82 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.825 179.741 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.19 -27.98 1.13 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.702 0.287 . . . . 0.0 111.679 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.34 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.332 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.44 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.59 -178.9 6.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.988 179.781 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 m -140.07 47.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.841 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.3 m . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.973 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.462 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 31.8 p . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.82 0.343 . . . . 0.0 110.892 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -126.75 27.48 6.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.462 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.64 159.41 35.7 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 111.171 -179.985 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.29 -25.41 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 123.142 2.561 . . . . 0.0 112.763 -179.914 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -59.62 -26.98 65.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.101 -179.797 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.01 -22.1 15.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.051 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.21 -143.35 41.18 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.695 179.888 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.29 55.66 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -179.861 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.07 8.49 20.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.431 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -59.81 -178.76 0.08 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.858 0.361 . . . . 0.0 111.035 -179.946 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -144.49 47.44 1.37 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.813 179.911 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.921 179.985 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 1.6 t . . . . . 0 N--CA 1.458 -0.04 0 CA-C-O 120.834 0.35 . . . . 0.0 110.903 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 t -117.62 28.84 8.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 179.804 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.471 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.43 171.33 6.32 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.382 179.828 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.471 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 56.4 Cg_endo -67.83 -11.66 32.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.383 2.055 . . . . 0.0 111.866 179.746 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -82.1 -29.36 31.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 110.787 179.638 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.6 -27.62 58.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.08 -146.51 23.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.966 179.696 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.78 -24.34 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.725 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.73 37.25 1.01 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.36 -179.976 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.402 ' HA ' ' O ' ' A' ' 2' ' ' CYS . 43.9 p90 -75.31 -174.12 2.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.858 0.361 . . . . 0.0 111.002 179.953 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -161.82 73.55 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.708 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.846 -179.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 29.8 p . . . . . 0 C--O 1.23 0.052 0 CA-C-O 120.839 0.352 . . . . 0.0 110.901 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -124.86 27.72 6.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.046 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.469 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -112.06 161.81 24.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.169 179.965 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -43.37 -25.99 0.87 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.27 2.647 . . . . 0.0 112.843 -179.891 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -59.64 -32.8 70.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -100.05 -29.13 12.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.9 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.77 -144.42 30.79 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.788 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.26 -26.93 1.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.1 40.33 1.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.467 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.64 -178.91 6.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.787 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -133.83 47.17 2.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.873 -179.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.864 0.364 . . . . 0.0 110.904 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -98.47 25.31 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.882 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.452 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.74 170.08 7.89 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.677 -179.975 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.4 Cg_endo -70.33 -10.8 28.91 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.453 2.102 . . . . 0.0 111.775 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -72.37 -25.81 61.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.758 179.599 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.0 -28.18 14.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.423 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.63 -144.47 30.08 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.819 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.87 -25.5 1.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.723 0.297 . . . . 0.0 111.728 -179.816 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 38.49 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.474 -179.828 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.423 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.14 -178.65 6.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 0.0 110.909 179.729 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -140.81 47.97 1.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.851 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.433 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.13 0 CA-C-O 120.803 0.335 . . . . 0.0 110.855 . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.4 t -116.37 27.93 8.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.063 -179.955 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' HIS . . . . . 0.446 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -114.02 169.49 6.47 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.616 179.746 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . 0.446 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 58.9 Cg_endo -69.4 41.86 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.545 2.163 . . . . 0.0 112.275 -179.899 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.412 ' H ' ' C ' ' A' ' 4' ' ' HIS . 6.8 mt-30 -120.28 -28.71 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.236 179.201 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.03 -23.16 14.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.031 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.15 -140.18 48.1 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.481 -179.911 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.39 -22.82 13.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.691 0.281 . . . . 0.0 111.558 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -95.67 35.76 1.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.528 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' TYR . . . . . 0.416 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.55 -178.7 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.909 179.766 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -130.71 53.38 1.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.886 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.83 0.347 . . . . 0.0 111.199 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.0 t -146.82 72.61 1.28 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.883 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.4 t -97.19 25.87 5.19 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.017 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.428 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.69 169.1 9.0 Favored Pre-proline 0 C--N 1.33 -0.253 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.639 -179.991 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.428 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 67.6 Cg_endo -71.07 -9.68 26.06 Favored 'Trans proline' 0 C--N 1.344 0.33 0 C-N-CA 122.45 2.1 . . . . 0.0 111.833 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.4 mm-40 -74.22 -23.79 59.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.863 179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.71 -26.47 14.05 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.982 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.439 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.86 -143.11 25.33 Favored Glycine 0 N--CA 1.449 -0.436 0 C-N-CA 120.917 -0.658 . . . . 0.0 112.837 179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.11 -27.94 1.09 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.747 0.308 . . . . 0.0 111.698 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.41 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.33 -179.9 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.439 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.81 -178.75 6.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.98 179.751 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.5 m -140.54 47.69 1.76 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.892 180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.2 m -60.85 -35.74 77.34 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.934 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.5 ptp85 -160.01 -48.39 0.05 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.935 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.7 mttm . . . . . 0 C--O 1.249 1.03 0 CA-C-O 118.18 -0.914 . . . . 0.0 110.922 179.963 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.879 0.371 . . . . 0.0 111.152 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 21.0 p -160.01 118.01 2.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.948 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.2 t -118.62 27.49 8.89 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.077 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.487 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.46 170.85 4.88 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.522 179.65 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.487 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 38.3 Cg_endo -64.66 -14.26 43.64 Favored 'Trans proline' 0 C--N 1.346 0.406 0 C-N-CA 122.365 2.043 . . . . 0.0 111.91 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 mm100 -62.31 -31.55 72.17 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.932 0.396 . . . . 0.0 110.604 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -94.73 -22.74 17.91 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.926 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.1 -140.35 48.05 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 120.817 -0.706 . . . . 0.0 112.539 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -60.56 -17.16 44.46 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.98 26.63 3.13 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 111.65 0.241 . . . . 0.0 111.65 -179.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -71.18 -178.52 2.05 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.797 0.332 . . . . 0.0 110.823 179.848 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 20.4 p -149.32 51.83 0.95 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.862 179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.5 m -60.02 -67.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.94 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.96 81.13 0.71 Allowed 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.935 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 8.3 mttt . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.252 -0.88 . . . . 0.0 110.896 -179.992 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 1.5 mpt_? . . . . . 0 N--CA 1.487 1.386 0 CA-C-O 120.847 0.356 . . . . 0.0 111.17 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.425 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.4 t -141.42 54.12 1.53 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.847 179.989 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.4 t -98.44 28.75 3.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.967 179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.448 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.75 169.43 9.17 Favored Pre-proline 0 C--N 1.33 -0.256 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.677 179.961 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.448 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.1 Cg_endo -70.49 -10.58 28.28 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.488 2.125 . . . . 0.0 111.809 179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -83.64 -25.16 31.02 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.765 179.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.3 m -80.04 -29.98 39.36 Favored 'General case' 0 N--CA 1.454 -0.257 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.908 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.74 -144.54 26.26 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.881 179.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.2 -24.57 4.42 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.676 0.274 . . . . 0.0 111.666 -179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.24 37.25 1.04 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.512 -0.313 . . . . 0.0 111.442 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.94 -178.47 3.78 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 0.0 110.904 179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.3 p -149.16 47.19 0.99 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.72 179.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m -67.94 -32.93 73.72 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.841 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.5 ttt180 -160.02 -67.55 0.07 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.931 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.182 -0.913 . . . . 0.0 110.915 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 15.9 mtm180 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.831 0.348 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.42 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.3 t -135.51 54.07 1.94 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.928 179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.2 t -98.44 28.78 3.94 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.926 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.446 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.77 169.47 9.1 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.668 179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.446 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.5 Cg_endo -70.46 -10.65 28.45 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.475 2.117 . . . . 0.0 111.881 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -83.61 -25.12 31.13 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.774 179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.2 m -80.04 -29.91 39.36 Favored 'General case' 0 N--CA 1.454 -0.263 0 CA-C-N 116.309 -0.405 . . . . 0.0 110.93 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.75 -144.53 26.32 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 121.006 -0.616 . . . . 0.0 112.926 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -51.42 -24.38 4.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.722 0.296 . . . . 0.0 111.692 -179.847 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.3 37.08 1.04 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.406 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -74.77 -178.47 3.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.448 -0.342 . . . . 0.0 110.858 179.87 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 12.1 p -149.14 47.19 0.99 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.746 179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.5 m -67.82 179.28 1.47 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.872 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -129.28 32.6 4.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.897 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.7 mttt . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.25 -0.881 . . . . 0.0 110.899 179.981 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 120.852 0.358 . . . . 0.0 111.202 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.435 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.1 OUTLIER -144.51 49.54 1.32 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.811 179.958 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -110.77 29.77 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.244 -179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.435 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -118.44 157.83 48.43 Favored Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 120.907 0.384 . . . . 0.0 111.024 179.887 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -43.92 -25.59 1.11 Allowed 'Trans proline' 0 C--N 1.345 0.375 0 C-N-CA 123.169 2.579 . . . . 0.0 113.014 -179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.8 tp-100 -59.54 -47.53 85.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.834 0.349 . . . . 0.0 111.061 -179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 14.0 m -77.86 -28.4 50.01 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.005 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 51.82 -139.44 28.06 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.897 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.22 -27.95 2.74 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.763 0.316 . . . . 0.0 111.579 -179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.55 41.85 1.09 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.321 -0.399 . . . . 0.0 111.139 179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 1.0 OUTLIER -77.6 -178.07 5.11 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.952 179.941 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -150.91 47.33 0.85 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.861 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 14.8 m -62.3 135.18 57.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.869 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -160.01 -65.69 0.07 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.924 179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.0 mttp . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.901 179.964 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 26.2 mmt-85 . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.844 0.354 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.476 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 23.2 p -121.61 120.31 34.42 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.971 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 30.7 t -121.0 27.64 8.35 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.024 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.486 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.79 170.76 4.95 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.558 179.66 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.486 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.89 -14.21 43.81 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 122.358 2.039 . . . . 0.0 111.927 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -62.61 -31.61 72.48 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-O 120.905 0.383 . . . . 0.0 110.584 179.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.1 m -93.35 -20.49 20.32 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.007 179.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.12 -139.61 48.27 Favored Glycine 0 N--CA 1.447 -0.579 0 C-N-CA 120.777 -0.725 . . . . 0.0 112.558 -179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.1 -14.6 55.91 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.99 21.0 6.1 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 111.691 0.256 . . . . 0.0 111.691 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -66.5 -178.45 0.69 Allowed 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.795 0.331 . . . . 0.0 110.869 179.784 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.6 m -152.57 53.25 0.78 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.839 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 30.6 m -60.05 107.66 0.66 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.871 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -135.28 -48.16 0.71 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.925 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.5 mttt . . . . . 0 C--O 1.249 1.064 0 CA-C-O 118.213 -0.899 . . . . 0.0 110.875 179.958 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 16.2 mtm180 . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.856 0.36 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.431 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 1.6 t -153.68 55.8 0.74 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.881 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.8 t -98.91 28.99 4.01 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.914 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.444 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.53 169.54 9.09 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.686 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.444 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 63.1 Cg_endo -70.59 -10.48 27.97 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.56 2.173 . . . . 0.0 111.868 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -84.01 -24.88 30.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.744 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.5 m -79.88 -29.13 39.89 Favored 'General case' 0 N--CA 1.454 -0.246 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.92 -179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.4 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.94 28.67 Favored Glycine 0 N--CA 1.449 -0.454 0 C-N-CA 120.971 -0.633 . . . . 0.0 112.884 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.31 -24.52 7.63 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.672 0.272 . . . . 0.0 111.548 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.26 37.4 1.11 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.291 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.4 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -72.72 -178.23 2.61 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.869 179.921 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -144.94 47.13 1.34 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.169 -0.468 . . . . 0.0 110.786 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 8.8 m -69.8 -173.83 0.67 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.885 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.4 ptt180 -101.07 31.87 3.46 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.878 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.906 -179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.837 0.351 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t -152.74 66.49 0.8 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.873 -179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.8 t -106.45 28.79 7.45 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.294 -0.412 . . . . 0.0 110.889 179.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.449 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.66 169.88 8.54 Favored Pre-proline 0 C--N 1.33 -0.239 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.561 179.965 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.449 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.0 Cg_endo -70.1 -10.74 28.99 Favored 'Trans proline' 0 C--N 1.345 0.353 0 C-N-CA 122.506 2.137 . . . . 0.0 111.816 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 -83.99 -25.57 29.88 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.736 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.2 m -77.37 -29.56 53.36 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.288 -0.414 . . . . 0.0 110.899 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.08 -145.1 30.86 Favored Glycine 0 N--CA 1.45 -0.42 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.889 179.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.27 -23.69 9.57 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.712 0.291 . . . . 0.0 111.617 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.27 1.14 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.352 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -71.53 -178.39 2.16 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.896 179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.7 m -147.02 47.12 1.16 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.8 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m -69.52 -66.31 0.6 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.892 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -159.46 -69.29 0.08 Allowed 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.895 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.9 pttm . . . . . 0 C--O 1.249 1.038 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.918 179.963 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.3 mmp_? . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.797 0.332 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.454 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 28.2 p -128.67 113.86 15.92 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.986 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -107.51 -23.55 12.13 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.933 179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.479 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -55.17 168.28 0.57 Allowed Pre-proline 0 C--N 1.331 -0.229 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.95 -179.921 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.479 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 56.5 Cg_endo -68.58 -11.33 31.61 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.491 2.127 . . . . 0.0 111.911 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 mm100 -62.31 -25.72 68.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.858 0.361 . . . . 0.0 110.654 179.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -99.57 -25.64 14.36 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.912 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.432 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.03 -145.1 38.09 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.823 -0.703 . . . . 0.0 112.655 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -49.29 -25.01 2.08 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 -179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.51 38.4 1.06 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.569 -179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.432 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.11 -178.85 6.9 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.861 0.362 . . . . 0.0 110.947 179.748 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.65 50.2 1.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.807 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.3 m -59.99 -169.87 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.927 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.29 36.96 1.51 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 0.0 110.858 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.936 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 5.0 ptt-85 . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.779 0.323 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t -132.81 71.46 1.47 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.919 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.2 t -110.22 27.79 9.27 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.899 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.455 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.4 169.91 8.59 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.642 179.966 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.455 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.91 -10.85 29.42 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.452 2.101 . . . . 0.0 111.873 179.7 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 52.5 mt-30 -83.83 -25.74 30.11 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.418 -0.355 . . . . 0.0 110.763 179.615 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 10.5 m -76.06 -31.63 58.88 Favored 'General case' 0 N--CA 1.455 -0.218 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.848 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.407 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.49 -140.41 33.19 Favored Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.781 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.06 -22.87 17.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.696 0.284 . . . . 0.0 111.508 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.95 35.14 1.28 Allowed 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.345 -179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.407 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -75.22 -178.61 4.0 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.869 0.366 . . . . 0.0 110.877 179.921 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -152.49 47.54 0.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.792 179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 23.5 m -65.72 -66.9 0.49 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.886 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -152.58 -61.87 0.16 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.875 -179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 71.9 mttt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.265 -0.874 . . . . 0.0 110.917 -179.965 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.86 0.362 . . . . 0.0 111.134 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.428 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -145.61 53.32 1.17 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.894 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.0 t -104.34 27.87 7.41 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.012 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.428 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.11 160.7 30.1 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-O 120.993 0.425 . . . . 0.0 111.17 179.945 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_exo -44.62 -26.91 2.01 Favored 'Trans proline' 0 C--N 1.343 0.251 0 C-N-CA 123.061 2.508 . . . . 0.0 112.606 -179.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mm-40 -59.81 -32.08 70.31 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.971 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.57 -27.23 16.04 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.923 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.17 -149.4 9.54 Favored Glycine 0 N--CA 1.45 -0.413 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.749 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.71 -25.13 1.64 Allowed 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 111.755 0.279 . . . . 0.0 111.755 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.89 39.12 1.07 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.493 -179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.74 -179.46 6.29 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.863 0.363 . . . . 0.0 111.084 179.781 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -142.53 52.17 1.44 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.821 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.7 m -59.96 158.48 10.78 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.927 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.96 33.44 0.18 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.927 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.1 pttp . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.294 -0.86 . . . . 0.0 110.956 179.987 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 31.8 mtt85 . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.784 0.326 . . . . 0.0 111.217 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 18.7 p -150.15 116.47 5.73 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.95 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 20.4 t -116.81 27.15 9.34 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.124 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.49 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.81 4.96 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.452 179.673 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.49 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.347 0.456 0 C-N-CA 122.323 2.015 . . . . 0.0 111.922 -179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -62.02 -31.52 71.92 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.89 0.376 . . . . 0.0 110.639 179.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -96.03 -25.66 15.83 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.846 179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.42 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.38 -142.14 47.0 Favored Glycine 0 N--CA 1.447 -0.59 0 C-N-CA 120.822 -0.704 . . . . 0.0 112.549 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.47 -21.65 10.54 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.672 0.272 . . . . 0.0 111.724 -179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.04 33.75 1.31 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.681 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.42 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -77.72 -178.59 5.45 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-O 120.854 0.359 . . . . 0.0 110.872 179.752 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -146.89 50.49 1.11 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.851 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 35.0 m -59.98 -31.38 69.85 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.937 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.3 ptp180 -132.83 35.51 3.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.946 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 mtmp? . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.901 -179.995 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 21.1 mtp85 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.861 0.362 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 12.0 p -160.03 98.68 1.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.016 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 8.8 t -97.67 23.95 7.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.856 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.461 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.48 170.44 7.2 Favored Pre-proline 0 C--N 1.33 -0.269 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.655 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.461 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.0 Cg_endo -69.56 -11.48 31.21 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.458 2.105 . . . . 0.0 111.829 179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -69.37 -27.12 65.05 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.718 179.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -98.21 -21.51 16.66 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.993 179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.45 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.38 -148.84 19.8 Favored Glycine 0 N--CA 1.449 -0.493 0 C-N-CA 120.871 -0.681 . . . . 0.0 112.72 179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.86 -23.93 1.27 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 111.867 0.321 . . . . 0.0 111.867 -179.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.15 36.88 0.98 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.635 -0.257 . . . . 0.0 111.671 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.45 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.7 OUTLIER -80.67 -178.4 6.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.877 0.37 . . . . 0.0 110.777 179.709 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -132.84 47.39 2.51 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.794 179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -80.94 -167.8 1.55 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.9 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.3 mtm105 -79.97 92.89 5.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.922 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.214 -0.898 . . . . 0.0 110.865 -179.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.7 ttt85 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.781 0.324 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.444 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 6.2 p -145.69 108.95 4.62 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.893 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 12.1 t -113.71 29.89 7.66 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.484 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -112.43 169.2 6.61 Favored Pre-proline 0 C--O 1.235 0.314 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.682 179.711 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.484 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.6 Cg_endo -70.29 40.49 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.416 0 C-N-CA 122.535 2.156 . . . . 0.0 112.236 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.422 ' H ' ' C ' ' A' ' 4' ' ' HIS . 59.4 mm-40 -120.16 -27.31 5.32 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.388 179.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.5 m -99.02 -6.0 29.36 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-N 116.143 -0.481 . . . . 0.0 111.22 179.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.422 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.39 -146.4 37.22 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.762 -0.732 . . . . 0.0 112.58 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.95 -15.44 43.47 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.12 24.06 3.99 Favored 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 111.697 0.258 . . . . 0.0 111.697 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.422 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -62.0 -178.06 0.15 Allowed 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.763 0.316 . . . . 0.0 110.796 179.836 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -148.17 76.61 1.38 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.87 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -89.08 175.19 7.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.887 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -79.99 -51.53 8.95 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.91 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 20.3 mttp . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.179 -0.915 . . . . 0.0 110.899 179.975 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 14.8 mtp180 . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.876 0.37 . . . . 0.0 111.196 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 11.7 p -113.36 121.41 44.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.888 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.1 t -119.7 26.88 9.07 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.084 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.485 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.53 170.8 4.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.496 179.731 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.485 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.2 Cg_endo -64.91 -14.05 42.96 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.319 2.013 . . . . 0.0 111.953 -179.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.6 mp0 -62.15 -31.66 72.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.908 0.385 . . . . 0.0 110.609 179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -94.99 -22.74 17.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.997 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.424 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.83 -139.05 48.62 Favored Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 120.795 -0.717 . . . . 0.0 112.501 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.8 -16.27 48.55 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 111.647 0.24 . . . . 0.0 111.647 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.78 24.79 3.93 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.703 0.26 . . . . 0.0 111.703 -179.72 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.424 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -69.43 -178.53 1.41 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.809 0.338 . . . . 0.0 110.882 179.796 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -141.95 54.2 1.48 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.914 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -90.45 -34.17 15.71 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.85 -179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.98 -67.57 0.07 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.877 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt . . . . . 0 C--O 1.249 1.04 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.918 -179.997 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.362 0 CA-C-O 120.846 0.355 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.7 t -155.5 69.77 0.7 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.859 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.2 t -108.76 28.43 8.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.887 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.452 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.41 169.99 8.46 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.618 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.5 Cg_endo -69.93 -10.92 29.56 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.446 2.097 . . . . 0.0 111.814 179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.1 pt20 -83.88 -25.77 29.96 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.796 179.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.1 m -76.36 -29.85 57.36 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.921 179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.402 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.9 -144.12 31.83 Favored Glycine 0 N--CA 1.449 -0.469 0 C-N-CA 120.922 -0.656 . . . . 0.0 112.828 179.78 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.18 -22.92 12.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.676 0.274 . . . . 0.0 111.594 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.13 35.24 1.19 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.498 -0.319 . . . . 0.0 111.334 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.402 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.8 OUTLIER -70.71 -178.34 1.82 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.852 0.358 . . . . 0.0 110.87 179.839 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -149.49 47.04 0.96 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.798 179.929 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 7.8 m -69.67 -35.44 75.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.829 -179.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -160.02 147.6 16.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.868 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 42.1 mttm . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.908 -179.989 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 11.5 mpt_? . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.77 0.319 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 13.0 p -144.78 115.17 7.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.875 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 15.6 t -114.62 26.77 9.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.11 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.494 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -109.68 170.85 4.93 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.359 -0.382 . . . . 0.0 110.502 179.602 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.494 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 37.7 Cg_endo -64.23 -14.57 44.61 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 122.345 2.03 . . . . 0.0 111.948 -179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -61.5 -31.36 71.35 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.864 0.364 . . . . 0.0 110.611 179.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -97.04 -25.02 15.51 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.911 179.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.425 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 59.51 -141.18 47.56 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.812 -0.709 . . . . 0.0 112.591 -179.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -55.47 -21.13 14.95 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.63 0.252 . . . . 0.0 111.633 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.41 33.3 1.42 Allowed 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.621 -0.263 . . . . 0.0 111.607 -179.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.425 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.53 -178.5 4.71 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.828 0.346 . . . . 0.0 110.885 179.703 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 3.2 t -146.07 63.98 1.23 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.914 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -86.61 129.45 34.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.902 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.56 -51.97 3.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.878 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.3 mttt . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.888 179.996 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 CA-C-O 120.77 0.319 . . . . 0.0 111.201 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.453 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 28.6 p -95.82 117.38 30.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.989 -179.912 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 33.6 t -121.64 28.18 7.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.922 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.484 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -110.9 170.64 5.06 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.517 179.737 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.484 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 39.6 Cg_endo -64.93 -14.26 44.19 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.311 2.008 . . . . 0.0 111.945 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 71.8 mt-30 -63.18 -31.5 72.66 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 120.886 0.374 . . . . 0.0 110.565 179.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -91.28 -19.29 23.14 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.0 179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.413 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 61.2 -140.96 47.92 Favored Glycine 0 N--CA 1.447 -0.6 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.493 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.78 -12.23 60.14 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.584 0.23 . . . . 0.0 111.615 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -89.86 12.67 16.61 Favored 'General case' 0 C--N 1.331 -0.205 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.413 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -60.51 -178.62 0.09 Allowed 'General case' 0 C--N 1.331 -0.198 0 CA-C-O 120.78 0.324 . . . . 0.0 110.83 179.95 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 39.0 m -154.1 53.3 0.69 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 110.882 179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -66.12 146.85 54.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.929 179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.7 ptt85 -108.14 -39.56 5.45 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.885 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 19.9 mtmt . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.209 -0.901 . . . . 0.0 110.877 179.99 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 51.0 mtm180 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.769 0.319 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -160.0 97.5 1.28 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.92 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -97.59 25.62 5.63 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.913 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.453 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.98 8.04 Favored Pre-proline 0 C--N 1.33 -0.247 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.677 179.998 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.453 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.7 Cg_endo -70.56 -10.59 28.24 Favored 'Trans proline' 0 C--N 1.344 0.308 0 C-N-CA 122.444 2.096 . . . . 0.0 111.811 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.9 mp0 -73.11 -25.16 60.76 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.446 -0.343 . . . . 0.0 110.793 179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.33 -28.17 14.16 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.855 179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.435 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.51 -144.58 29.41 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.927 -0.654 . . . . 0.0 112.806 179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.79 -26.3 1.57 Allowed 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.89 39.51 1.04 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.487 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.435 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.53 -178.67 6.46 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.815 0.34 . . . . 0.0 110.928 179.725 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.7 m -143.48 49.98 1.4 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.882 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.0 m -61.58 85.27 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.898 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.8 mmm-85 -106.84 88.77 2.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.91 179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.6 mttm . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.253 -0.88 . . . . 0.0 110.911 -179.99 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.389 0 CA-C-O 120.825 0.345 . . . . 0.0 111.176 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.447 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 4.8 p -149.23 113.07 5.11 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.924 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.7 t -116.18 30.27 7.45 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.018 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.475 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -113.26 169.14 6.74 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.688 179.703 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.475 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -70.4 40.42 0.33 Allowed 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.564 2.176 . . . . 0.0 112.165 -179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.42 ' H ' ' C ' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -120.17 -27.06 5.36 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.375 179.257 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -99.42 -11.36 21.2 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.216 179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.428 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 58.42 -145.77 41.56 Favored Glycine 0 N--CA 1.446 -0.642 0 C-N-CA 120.77 -0.728 . . . . 0.0 112.545 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.61 -17.13 30.75 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.74 0.274 . . . . 0.0 111.74 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.59 27.25 2.71 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 111.7 0.259 . . . . 0.0 111.7 -179.713 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.428 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.6 OUTLIER -65.55 -178.11 0.5 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 120.793 0.33 . . . . 0.0 110.845 179.743 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.13 47.63 1.7 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.814 179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 40.1 m -61.35 85.62 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.904 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -114.07 -65.45 1.19 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.899 179.978 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.251 -0.881 . . . . 0.0 110.902 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 6.1 ttp85 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.923 0.392 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.6 t -143.83 66.04 1.3 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.887 179.978 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.5 t -106.44 28.58 7.65 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.883 179.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.445 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -95.68 169.89 8.52 Favored Pre-proline 0 C--N 1.331 -0.239 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.604 179.956 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 60.8 Cg_endo -69.98 -10.81 29.26 Favored 'Trans proline' 0 C--N 1.344 0.326 0 C-N-CA 122.437 2.091 . . . . 0.0 111.881 179.715 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -83.65 -25.82 30.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.739 179.646 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 9.0 m -77.5 -29.43 52.5 Favored 'General case' 0 N--CA 1.454 -0.252 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.963 179.981 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.404 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.85 -145.07 29.99 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 121.001 -0.619 . . . . 0.0 112.797 179.768 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.13 -23.79 8.94 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.644 0.259 . . . . 0.0 111.604 -179.827 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.2 36.35 1.14 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.327 -179.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.404 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.9 OUTLIER -71.65 -178.35 2.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.888 179.88 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.1 m -146.97 47.18 1.16 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.752 179.944 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 9.1 m -69.44 154.08 42.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.907 -179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -159.94 152.47 21.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.867 179.96 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.6 mttt . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.248 -0.882 . . . . 0.0 110.897 179.969 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.4 tpp180 . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.861 0.362 . . . . 0.0 111.144 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.442 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.5 OUTLIER -140.19 53.32 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.887 179.959 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 9.1 t -104.44 27.9 7.44 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.958 179.951 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.442 ' CE1' ' HA ' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.09 160.71 30.01 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 120.97 0.414 . . . . 0.0 111.125 -179.975 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -44.53 -27.03 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 123.146 2.564 . . . . 0.0 112.583 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.76 -32.31 70.46 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.035 -179.818 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.39 -27.24 16.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.911 179.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.451 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 52.08 -149.56 9.2 Favored Glycine 0 N--CA 1.449 -0.446 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.743 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.42 -25.23 1.54 Allowed 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 -179.889 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.9 39.27 1.07 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.517 -0.31 . . . . 0.0 111.488 -179.805 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.451 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -87.9 -179.41 6.23 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 120.86 0.362 . . . . 0.0 111.07 179.785 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 58.7 m -142.41 52.0 1.45 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.828 179.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 17.9 m -59.97 -31.61 70.05 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.926 179.996 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.07 35.38 4.45 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.899 179.993 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.0 pttt . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.895 179.974 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 7.8 mtm-85 . . . . . 0 N--CA 1.487 1.39 0 CA-C-O 120.838 0.351 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 19.6 p -159.99 97.6 1.28 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.882 -179.992 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.0 t -97.65 25.48 5.78 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.917 179.922 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.448 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.69 169.96 8.08 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-N 116.242 -0.436 . . . . 0.0 110.688 -179.945 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.448 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 62.6 Cg_endo -70.57 -10.49 28.02 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 122.454 2.103 . . . . 0.0 111.799 179.727 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.1 tm0? -73.03 -25.22 60.86 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.465 -0.334 . . . . 0.0 110.785 179.597 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.31 -27.86 14.31 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.279 -0.418 . . . . 0.0 110.841 179.964 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.436 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.49 -144.53 29.43 Favored Glycine 0 N--CA 1.45 -0.421 0 C-N-CA 120.91 -0.662 . . . . 0.0 112.747 179.816 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.58 -26.51 1.48 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.671 0.272 . . . . 0.0 111.68 -179.839 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 39.68 1.04 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.522 -179.813 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.436 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.84 -178.63 6.37 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.829 0.347 . . . . 0.0 110.888 179.811 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -144.95 56.9 1.27 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.806 179.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 10.4 m -69.28 94.16 0.68 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.878 -179.985 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.6 tpt180 -134.65 -66.49 0.6 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.873 179.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 5.8 pttt . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.854 -179.982 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 32.5 mmt180 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 120.793 0.33 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 20.4 p -159.76 98.16 1.34 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.002 179.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.9 t -98.09 25.7 5.89 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.937 179.839 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.445 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.53 169.86 8.27 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.706 -179.966 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.445 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 64.5 Cg_endo -70.67 -10.92 28.81 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 122.529 2.153 . . . . 0.0 111.865 179.748 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.28 -24.61 60.45 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.77 179.655 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.35 -27.98 14.24 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.872 179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.42 -145.01 28.25 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.891 -0.671 . . . . 0.0 112.828 179.835 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.27 -26.65 1.28 Allowed 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 111.768 0.285 . . . . 0.0 111.768 -179.893 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.83 39.93 1.05 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.467 -179.848 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.94 -178.51 6.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.955 179.718 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -141.96 47.91 1.62 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.895 179.98 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 24.4 m -60.0 119.07 7.08 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.907 -179.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 7.3 tmm_? -147.81 -58.03 0.25 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.911 -179.989 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.263 -0.875 . . . . 0.0 110.917 -179.991 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 93.5 mtm-85 . . . . . 0 N--CA 1.486 1.326 0 CA-C-O 120.846 0.355 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.2 t -146.88 72.66 1.28 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.927 -179.972 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 7.2 t -97.11 25.98 5.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.013 179.981 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.438 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -97.8 169.13 8.94 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.678 179.995 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.438 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 66.9 Cg_endo -71.01 -9.9 26.53 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 122.443 2.095 . . . . 0.0 111.819 179.754 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.4 mp0 -73.89 -24.06 59.66 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.47 -0.332 . . . . 0.0 110.881 179.65 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.7 m -99.65 -26.44 14.07 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.944 179.963 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.44 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 53.01 -143.25 25.82 Favored Glycine 0 N--CA 1.449 -0.433 0 C-N-CA 120.895 -0.669 . . . . 0.0 112.825 179.741 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -46.19 -27.98 1.13 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.702 0.287 . . . . 0.0 111.679 -179.907 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.34 41.72 1.09 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.332 -179.913 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.44 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.59 -178.9 6.5 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.988 179.781 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 m -140.07 47.53 1.81 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.841 179.961 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 34.3 m -60.7 -67.31 0.41 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.956 179.973 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.3 mtt180 -131.74 -173.12 3.04 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.884 179.952 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.3 mttp . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.257 -0.878 . . . . 0.0 110.907 179.993 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 4.1 mpt_? . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.823 0.344 . . . . 0.0 111.189 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.462 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 31.8 p -112.95 120.93 43.1 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.892 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.4 t -126.75 27.48 6.04 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.035 -179.889 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.462 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -113.64 159.41 35.7 Favored Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.013 0.435 . . . . 0.0 111.171 -179.985 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.29 -25.41 1.99 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 123.142 2.561 . . . . 0.0 112.763 -179.914 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 22.3 mm-40 -59.62 -26.98 65.92 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.101 -179.797 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -100.01 -22.1 15.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.051 179.901 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 57.21 -143.35 41.18 Favored Glycine 0 N--CA 1.448 -0.535 0 C-N-CA 120.815 -0.707 . . . . 0.0 112.695 179.888 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.81 -17.29 55.66 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 111.622 0.23 . . . . 0.0 111.622 -179.861 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -86.07 8.49 20.53 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -179.8 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.431 ' N ' ' CD1' ' A' ' 11' ' ' TYR . 0.0 OUTLIER -59.81 -178.76 0.08 Allowed 'General case' 0 C--N 1.332 -0.196 0 CA-C-O 120.858 0.361 . . . . 0.0 111.035 -179.946 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.6 t -144.49 47.44 1.37 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.813 179.911 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -69.27 -169.62 0.21 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.921 179.985 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.09 31.2 1.77 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.895 -179.979 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.8 mtpm? . . . . . 0 C--O 1.25 1.089 0 CA-C-O 118.205 -0.902 . . . . 0.0 110.856 -179.991 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.837 0.351 . . . . 0.0 111.187 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.402 ' O ' ' HA ' ' A' ' 11' ' ' TYR . 1.6 t -146.01 76.26 1.45 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.903 -179.978 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.1 t -117.62 28.84 8.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.967 0.413 . . . . 0.0 110.793 179.804 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.471 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.43 171.33 6.32 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.382 179.828 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.471 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 56.4 Cg_endo -67.83 -11.66 32.8 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.383 2.055 . . . . 0.0 111.866 179.746 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -82.1 -29.36 31.79 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.835 0.35 . . . . 0.0 110.787 179.638 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 6.0 m -75.6 -27.62 58.58 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.825 179.969 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . 54.08 -146.51 23.49 Favored Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.972 -0.632 . . . . 0.0 112.966 179.696 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -50.78 -24.34 3.4 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -179.725 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.73 37.25 1.01 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.533 -0.303 . . . . 0.0 111.36 -179.976 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.402 ' HA ' ' O ' ' A' ' 2' ' ' CYS . 43.9 p90 -75.31 -174.12 2.28 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.858 0.361 . . . . 0.0 111.002 179.953 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 17.3 m -161.82 73.55 0.42 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.708 179.911 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -93.64 -169.39 2.1 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.846 -179.864 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.9 tpt85 -149.54 79.47 1.39 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.904 -179.99 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.26 -0.876 . . . . 0.0 110.867 -179.991 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 57.0 mtp180 . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.852 0.358 . . . . 0.0 111.201 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.469 ' HB2' ' CE1' ' A' ' 4' ' ' HIS . 29.8 p -159.98 117.76 2.63 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.901 -179.998 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 34.0 t -124.86 27.72 6.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.046 -179.867 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.469 ' CE1' ' HB2' ' A' ' 2' ' ' CYS . 0.2 OUTLIER -112.06 161.81 24.19 Favored Pre-proline 0 C--N 1.33 -0.26 0 CA-C-O 120.982 0.42 . . . . 0.0 111.169 179.965 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -43.37 -25.99 0.87 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 123.27 2.647 . . . . 0.0 112.843 -179.891 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -59.64 -32.8 70.78 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.036 -179.674 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -100.05 -29.13 12.7 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.9 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.433 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.77 -144.42 30.79 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.788 179.839 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -47.26 -26.93 1.34 Allowed 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 111.751 0.278 . . . . 0.0 111.751 -179.852 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -93.1 40.33 1.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.467 -179.853 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.433 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -86.64 -178.91 6.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.982 179.787 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.8 t -133.83 47.17 2.47 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.803 179.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -75.08 -169.25 0.89 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.873 -179.99 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.89 79.6 9.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.919 179.992 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.2 mtmt . . . . . 0 C--O 1.249 1.048 0 CA-C-O 118.223 -0.894 . . . . 0.0 110.934 179.995 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.35 0 CA-C-O 120.9 0.381 . . . . 0.0 111.184 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 21.3 p -140.32 97.84 3.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.904 179.965 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 6.6 t -98.47 25.31 6.46 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.871 179.882 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.452 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -96.74 170.08 7.89 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.677 -179.975 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.452 ' HD2' ' CB ' ' A' ' 4' ' ' HIS . 61.4 Cg_endo -70.33 -10.8 28.91 Favored 'Trans proline' 0 C--N 1.345 0.348 0 C-N-CA 122.453 2.102 . . . . 0.0 111.775 179.731 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -72.37 -25.81 61.66 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.758 179.599 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -97.0 -28.18 14.28 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.312 -0.404 . . . . 0.0 110.861 179.865 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.423 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 54.63 -144.47 30.08 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.892 -0.671 . . . . 0.0 112.819 179.838 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -48.87 -25.5 1.93 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.723 0.297 . . . . 0.0 111.728 -179.816 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.87 38.49 1.03 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.474 -179.828 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.423 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -85.14 -178.65 6.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-O 120.826 0.346 . . . . 0.0 110.909 179.729 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -140.81 47.97 1.73 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.851 179.992 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.57 -33.53 74.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.901 179.977 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -153.38 79.37 1.17 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.947 179.97 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 34.9 mmtt . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.216 -0.897 . . . . 0.0 110.874 -179.942 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' ARG . . . . . . . . . . . . . 2.2 ptt-85 . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 120.792 0.33 . . . . 0.0 111.187 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.433 ' HA ' ' CE1' ' A' ' 4' ' ' HIS . 0.9 OUTLIER -80.09 78.75 6.71 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.855 -179.991 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 17.4 t -116.37 27.93 8.9 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.063 -179.955 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.446 ' HB2' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -114.02 169.49 6.47 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.616 179.746 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.446 ' HD2' ' HB2' ' A' ' 4' ' ' HIS . 58.9 Cg_endo -69.4 41.86 0.31 Allowed 'Trans proline' 0 C--N 1.347 0.492 0 C-N-CA 122.545 2.163 . . . . 0.0 112.275 -179.899 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.412 ' H ' ' C ' ' A' ' 4' ' ' HIS . 6.8 mt-30 -120.28 -28.71 4.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.236 179.201 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.6 m -100.03 -23.16 14.97 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.031 179.753 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' GLY . . . . . 0.416 ' O ' ' CD2' ' A' ' 11' ' ' TYR . . . 60.15 -140.18 48.1 Favored Glycine 0 N--CA 1.447 -0.625 0 C-N-CA 120.783 -0.723 . . . . 0.0 112.481 -179.911 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -54.39 -22.82 13.45 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.691 0.281 . . . . 0.0 111.558 -179.921 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -95.67 35.76 1.34 Allowed 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.529 -0.305 . . . . 0.0 111.528 -179.755 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' TYR . . . . . 0.416 ' CD2' ' O ' ' A' ' 8' ' ' GLY . 0.1 OUTLIER -76.55 -178.7 4.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.475 -0.33 . . . . 0.0 110.909 179.766 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.9 m -130.71 53.38 1.97 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.229 -0.442 . . . . 0.0 110.886 -179.986 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -107.02 -31.57 8.24 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.832 -179.995 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -119.85 -45.34 2.49 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.932 179.995 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 10.7 mtmt . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.228 -0.891 . . . . 0.0 110.905 179.991 . . . . . . . . 0 0 . 1 stop_ save_