data_1fi0_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 1fi0 _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.477 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.255 0.55 . . . . 0.0 109.821 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.511 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 1.3 mp -51.03 -63.23 1.2 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.137 -0.977 . . . . 0.0 109.188 179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 74.8 tt0 -56.29 -26.63 52.64 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.241 -0.912 . . . . 0.0 109.27 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.477 ' HB2' ' O ' ' A' ' 19' ' ' THR . 1.1 mm? -68.54 -46.1 70.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.447 -0.783 . . . . 0.0 109.755 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.535 ' O ' ' N ' ' A' ' 26' ' ' LEU . 2.2 mm? -70.11 -28.11 65.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.172 -0.955 . . . . 0.0 109.46 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 88.5 mt-10 -49.83 -24.25 2.32 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -81.84 -24.93 35.55 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' A' ' 23' ' ' LEU . 20.7 mt -78.28 -39.44 39.97 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.438 ' HE2' HG22 ' A' ' 31' ' ' VAL . 1.6 ttpm? -60.5 -45.38 93.99 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.58 -0.7 . . . . 0.0 109.21 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 46.5 m -58.11 -41.42 83.52 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.438 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 71.1 mm-40 -63.18 -52.93 60.41 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.15 -45.4 79.64 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.438 HG22 ' HE2' ' A' ' 27' ' ' LYS . 98.7 t -64.84 -29.01 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 178.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 28' ' ' SER . 32.2 mtt-85 -76.35 -23.1 54.17 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.498 0.666 . . . . 0.0 109.533 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.203 -179.584 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.348 0.594 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.571 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 2.7 mp -61.37 -42.82 99.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.366 -0.834 . . . . 0.0 109.938 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.494 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 9.9 tp10 -66.33 -36.28 82.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.933 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -46.27 86.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.781 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.543 ' O ' ' N ' ' A' ' 26' ' ' LEU . 57.3 mt -67.24 -29.13 68.69 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.151 -0.968 . . . . 0.0 109.908 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 20.3 mm-40 -50.8 -23.82 3.03 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.036 -1.04 . . . . 0.0 108.233 179.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -76.0 -27.01 57.25 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.543 ' N ' ' O ' ' A' ' 23' ' ' LEU . 42.2 mt -83.82 -37.0 23.09 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.51 ' CD ' HG21 ' A' ' 31' ' ' VAL . 1.4 tmmt? -61.22 -47.21 87.15 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.521 -0.737 . . . . 0.0 109.543 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 49.3 m -56.77 -37.12 70.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.497 -0.752 . . . . 0.0 109.014 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.436 ' OE1' ' HA ' ' A' ' 26' ' ' LEU . 44.7 mt-10 -64.37 -55.56 20.27 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.45 ' O ' ' OXT' ' A' ' 33' ' ' HIS . . . -56.65 -46.24 81.16 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.51 HG21 ' CD ' ' A' ' 27' ' ' LYS . 73.6 t -64.3 -28.36 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.496 ' CG ' ' O ' ' A' ' 28' ' ' SER . 3.6 mtt180 -77.55 -28.58 51.92 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.583 0.706 . . . . 0.0 109.405 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.45 ' OXT' ' O ' ' A' ' 30' ' ' ALA . 33.3 m-70 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.056 -0.974 . . . . 0.0 110.189 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 121.248 0.547 . . . . 0.0 109.889 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.509 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 5.9 mp -46.39 -49.5 17.85 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.082 -1.011 . . . . 0.0 109.34 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.477 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 52.7 tt0 -62.09 -19.11 62.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.357 -0.839 . . . . 0.0 109.46 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.544 ' O ' ' CG ' ' A' ' 25' ' ' GLU . 12.5 tp -80.12 -38.08 32.31 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.307 -0.871 . . . . 0.0 109.39 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.413 ' HA ' ' HB2' ' A' ' 26' ' ' LEU . 71.6 mt -77.82 -24.23 48.77 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.0 178.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.477 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 36.9 mm-40 -52.9 -26.64 15.49 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 121.218 -0.926 . . . . 0.0 108.529 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.544 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -94.11 -12.27 28.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.428 -0.795 . . . . 0.0 109.238 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 23' ' ' LEU . 78.7 mt -92.12 -28.36 17.15 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.268 -0.895 . . . . 0.0 109.009 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.461 ' NZ ' ' HB3' ' A' ' 27' ' ' LYS . 1.8 ttpm? -65.51 -34.8 79.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.495 -0.753 . . . . 0.0 109.944 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.494 ' O ' ' N ' ' A' ' 32' ' ' ARG . 91.8 p -58.41 -40.14 81.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.235 -0.916 . . . . 0.0 109.262 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.519 ' OE2' ' CD2' ' A' ' 33' ' ' HIS . 51.6 tp10 -64.26 -54.65 30.0 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -45.99 78.36 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.402 HG21 ' HG2' ' A' ' 27' ' ' LYS . 81.9 t -64.41 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 28' ' ' SER . 10.7 mtp180 -80.63 -28.33 36.99 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.559 0.695 . . . . 0.0 109.477 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.519 ' CD2' ' OE2' ' A' ' 29' ' ' GLU . 23.1 m-70 . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.207 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.413 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 17.3 m . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.215 0.531 . . . . 0.0 109.966 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.5 mp -51.5 -56.13 15.09 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 110.035 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 53.5 tt0 -51.86 -37.72 53.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.195 -0.941 . . . . 0.0 109.976 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.461 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 0.5 OUTLIER -64.58 -36.96 85.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.962 -1.086 . . . . 0.0 109.37 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.53 ' O ' ' N ' ' A' ' 26' ' ' LEU . 75.2 mt -75.23 -25.82 58.41 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.692 -0.803 . . . . 0.0 109.522 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.487 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 74.0 mt-10 -51.5 -23.14 3.7 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 8.9 pt-20 -82.26 -21.42 36.25 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 23' ' ' LEU . 33.4 mt -89.73 -32.52 16.96 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.46 ' HE2' HG22 ' A' ' 31' ' ' VAL . 2.4 ttpm? -64.46 -40.0 94.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.497 -0.752 . . . . 0.0 110.141 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.471 ' O ' ' N ' ' A' ' 32' ' ' ARG . 79.5 p -58.43 -40.49 82.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.203 -0.936 . . . . 0.0 109.288 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.459 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 22.7 tp10 -64.25 -53.75 44.21 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.36 -44.68 76.23 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.46 HG22 ' HE2' ' A' ' 27' ' ' LYS . 74.4 t -65.8 -28.4 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 28' ' ' SER . 10.5 mtt-85 -78.38 -24.62 46.26 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.448 0.642 . . . . 0.0 109.591 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.26 -179.482 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.183 0.516 . . . . 0.0 110.142 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.479 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 82.0 mt -47.89 -40.64 22.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.897 -1.127 . . . . 0.0 109.451 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 83.8 tt0 -66.22 -33.77 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.346 -0.847 . . . . 0.0 109.943 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.576 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -60.17 -28.72 68.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -0.949 . . . . 0.0 109.021 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.507 ' O ' ' N ' ' A' ' 26' ' ' LEU . 83.2 mt -94.84 -23.43 17.48 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 48.3 mm-40 -49.39 -32.66 11.96 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 20.9 pt-20 -80.06 -21.72 43.11 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.699 -0.801 . . . . 0.0 109.15 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' A' ' 23' ' ' LEU . 18.9 mt -82.46 -33.73 28.35 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.369 -0.832 . . . . 0.0 109.369 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -61.29 -47.12 87.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.382 -0.824 . . . . 0.0 109.535 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 92.7 p -56.45 -36.84 69.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.595 -0.842 . . . . 0.0 108.832 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.486 ' O ' ' N ' ' A' ' 33' ' ' HIS . 89.6 mt-10 -65.81 -55.32 17.76 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.43 -45.55 80.7 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -64.28 -27.56 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.522 ' CG ' ' O ' ' A' ' 28' ' ' SER . 9.9 mtp180 -81.77 -32.6 31.36 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.475 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.486 ' N ' ' O ' ' A' ' 29' ' ' GLU . 20.1 m-70 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.023 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.479 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.195 0.521 . . . . 0.0 109.805 . . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.546 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 2.0 mp -55.07 -49.78 70.78 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.996 -1.065 . . . . 0.0 108.587 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 24' ' ' GLU . 39.6 tt0 -68.22 -27.0 65.99 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.497 -0.752 . . . . 0.0 109.277 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.492 ' C ' ' CD1' ' A' ' 22' ' ' LEU . 3.1 tm? -57.27 -40.09 76.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.382 -0.824 . . . . 0.0 109.197 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 26' ' ' LEU . 89.4 mt -92.23 -21.2 20.47 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.511 -0.743 . . . . 0.0 109.888 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 26.1 mm-40 -50.64 -22.38 2.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.246 -0.908 . . . . 0.0 108.906 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.414 ' OE2' ' O ' ' A' ' 22' ' ' LEU . 18.4 pt-20 -82.93 -26.93 30.95 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' A' ' 23' ' ' LEU . 54.8 mt -80.9 -34.06 33.8 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.463 -0.773 . . . . 0.0 109.105 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.492 ' HG2' HG23 ' A' ' 31' ' ' VAL . 9.5 ttpp -59.26 -46.55 88.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 109.441 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.3 m -57.7 -42.05 82.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.737 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 92.9 mt-10 -62.05 -52.72 62.8 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.31 83.38 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.492 HG23 ' HG2' ' A' ' 27' ' ' LYS . 69.2 t -62.24 -29.98 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 28' ' ' SER . 57.8 mtt180 -75.46 -28.85 59.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.559 0.695 . . . . 0.0 109.506 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.989 -179.457 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.507 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 43.3 m . . . . . 0 N--CA 1.495 1.818 0 CA-C-O 121.28 0.562 . . . . 0.0 110.049 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.47 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 7.0 mp -47.41 -52.58 16.43 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.016 -1.053 . . . . 0.0 108.466 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.462 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 84.2 tt0 -68.91 -28.02 66.29 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.507 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 3.4 tm? -65.36 -33.53 76.17 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 26' ' ' LEU . 87.3 mt -94.16 -18.22 21.96 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.535 -0.728 . . . . 0.0 109.769 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 5.7 mt-10 -51.75 -21.44 2.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.064 -1.022 . . . . 0.0 109.127 179.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -80.59 -23.57 39.76 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' A' ' 23' ' ' LEU . 18.7 mt -91.8 -36.77 13.35 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.517 -0.739 . . . . 0.0 109.572 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.532 ' HG3' ' N ' ' A' ' 28' ' ' SER . 13.6 pttp -60.21 -38.43 83.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 0.0 109.799 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.532 ' N ' ' HG3' ' A' ' 27' ' ' LYS . 30.0 m -67.06 -33.5 75.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.291 -0.88 . . . . 0.0 109.488 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -63.99 -55.85 19.34 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.53 76.59 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.178 -0.951 . . . . 0.0 108.555 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.453 HG21 ' O ' ' A' ' 27' ' ' LYS . 39.0 t -68.04 -28.24 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.468 ' N ' ' O ' ' A' ' 28' ' ' SER . 5.1 mtp180 -81.11 -25.28 37.08 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.546 0.688 . . . . 0.0 109.477 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.184 -179.525 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.32 0.581 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 8.4 mp -60.97 -46.21 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.261 -0.899 . . . . 0.0 109.602 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 27.7 tt0 -62.33 -35.34 78.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.852 . . . . 0.0 109.972 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -39.9 95.14 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.176 -0.952 . . . . 0.0 109.606 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' A' ' 26' ' ' LEU . 91.9 mt -71.52 -28.3 63.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.379 -0.826 . . . . 0.0 109.937 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 95.1 mt-10 -51.09 -22.95 2.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 23' ' ' LEU . 62.8 mt -82.23 -40.96 20.89 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.477 ' HE2' HG22 ' A' ' 31' ' ' VAL . 1.6 ttpm? -58.52 -44.77 89.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.515 -0.74 . . . . 0.0 109.22 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 89.9 p -58.94 -37.35 76.52 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 94.3 mt-10 -63.78 -53.04 57.09 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.11 -47.4 83.39 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.477 HG22 ' HE2' ' A' ' 27' ' ' LYS . 96.9 t -63.12 -28.41 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 28' ' ' SER . 12.7 mtt85 -76.77 -34.48 58.01 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.598 0.713 . . . . 0.0 109.435 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 117.974 -1.013 . . . . 0.0 109.899 -179.38 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 60.4 m . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.136 0.494 . . . . 0.0 109.885 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.449 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 5.3 mp -51.1 -52.97 38.48 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.988 -1.07 . . . . 0.0 109.117 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.409 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 75.3 tt0 -73.78 -15.76 61.18 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.0 109.22 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.493 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.4 tm? -73.69 -33.69 64.53 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.429 -0.794 . . . . 0.0 109.47 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.516 ' CD2' HD13 ' A' ' 26' ' ' LEU . 34.4 mt -98.22 -19.41 17.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.49 -0.757 . . . . 0.0 109.661 179.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 11.3 mm-40 -49.14 -27.07 3.2 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.326 -0.859 . . . . 0.0 108.843 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -83.35 -22.25 32.9 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.57 -0.706 . . . . 0.0 109.319 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.516 HD13 ' CD2' ' A' ' 23' ' ' LEU . 27.8 mt -85.83 -27.98 24.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.38 -0.825 . . . . 0.0 109.277 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HG2' HG22 ' A' ' 31' ' ' VAL . 19.4 ttpp -61.35 -47.43 85.89 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.465 -0.772 . . . . 0.0 109.35 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CD ' ' A' ' 32' ' ' ARG . 87.5 p -56.51 -38.75 72.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 32' ' ' ARG . 96.3 mt-10 -64.9 -56.47 13.12 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.2 -45.51 79.83 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.439 HG22 ' HG2' ' A' ' 27' ' ' LYS . 78.4 t -65.22 -28.27 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.522 ' CD ' ' O ' ' A' ' 28' ' ' SER . 3.7 mtp180 -79.41 -32.88 42.98 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.619 0.723 . . . . 0.0 109.384 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 29' ' ' GLU . 26.4 m-70 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.156 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.5 m . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 121.547 0.689 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.2 tp -45.28 -51.78 10.48 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.511 -0.743 . . . . 0.0 109.927 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.477 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 72.1 tt0 -67.04 -30.78 70.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.154 -0.967 . . . . 0.0 110.231 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.51 -38.3 74.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.95 -1.094 . . . . 0.0 109.641 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.506 ' O ' ' N ' ' A' ' 26' ' ' LEU . 55.0 mt -64.91 -24.23 67.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.261 -0.9 . . . . 0.0 109.844 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 95.4 mt-10 -51.42 -22.58 3.11 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.433 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -77.57 -26.16 50.62 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 23' ' ' LEU . 19.6 mt -83.72 -36.99 23.26 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.412 0.625 . . . . 0.0 109.399 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.445 ' HG2' HG21 ' A' ' 31' ' ' VAL . 1.7 ttpm? -60.03 -45.69 91.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.397 -0.814 . . . . 0.0 109.44 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.477 ' O ' ' N ' ' A' ' 32' ' ' ARG . 22.6 t -56.18 -38.26 70.7 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.459 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 78.2 mt-10 -64.74 -55.1 21.96 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -44.07 77.0 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.445 HG21 ' HG2' ' A' ' 27' ' ' LYS . 41.8 t -66.15 -27.28 40.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 28' ' ' SER . 36.0 mtt-85 -78.66 -34.11 46.62 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.538 0.685 . . . . 0.0 109.471 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' A' ' 29' ' ' GLU . 35.5 m-70 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.203 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 1.8 m . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.279 0.561 . . . . 0.0 109.856 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.457 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 36.1 mt -48.11 -32.9 7.45 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.14 -0.975 . . . . 0.0 109.698 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.506 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 88.0 tt0 -75.71 -26.4 57.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.319 -0.863 . . . . 0.0 109.733 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.559 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -66.53 -41.47 88.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.215 -0.928 . . . . 0.0 109.325 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 26' ' ' LEU . 88.7 mt -68.92 -22.89 64.13 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.346 -0.846 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.506 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 65.6 mm-40 -50.25 -30.71 12.33 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.196 -1.001 . . . . 0.0 108.415 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -78.34 -24.32 46.57 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 23' ' ' LEU . 40.8 mt -87.22 -27.72 22.8 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.603 -0.685 . . . . 0.0 109.26 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.451 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.6 ttpm? -63.91 -48.26 77.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.502 -0.749 . . . . 0.0 109.39 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 23.0 t -55.91 -38.38 70.16 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.335 -0.853 . . . . 0.0 108.878 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 71.8 mm-40 -64.39 -55.77 18.79 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.68 -44.16 81.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.451 HG21 ' HE2' ' A' ' 27' ' ' LYS . 77.2 t -66.66 -25.47 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 28' ' ' SER . 65.8 mtt180 -81.03 -22.57 39.26 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-O 121.497 0.665 . . . . 0.0 109.456 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 42.5 m-70 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.148 -179.359 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.038 0.447 . . . . 0.0 110.343 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.464 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 88.2 mt -44.28 -45.03 8.43 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.104 -0.997 . . . . 0.0 109.171 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.484 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 88.2 tt0 -74.5 -27.23 60.46 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.364 -0.835 . . . . 0.0 108.792 178.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 19' ' ' THR . 3.4 tm? -65.48 -37.47 86.92 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.592 -0.692 . . . . 0.0 109.515 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.512 ' O ' ' N ' ' A' ' 26' ' ' LEU . 92.2 mt -92.31 -19.3 22.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.406 -0.808 . . . . 0.0 109.987 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.484 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 7.9 mm-40 -49.51 -23.76 1.75 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 108.849 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -78.57 -29.9 46.5 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 23' ' ' LEU . 63.8 mt -79.55 -33.96 41.43 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 121.577 -0.702 . . . . 0.0 109.203 179.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.3 ttpm? -62.8 -48.14 80.4 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.408 -0.808 . . . . 0.0 109.366 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.472 ' O ' ' N ' ' A' ' 32' ' ' ARG . 58.2 m -55.1 -36.35 65.58 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.635 -0.826 . . . . 0.0 108.906 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 95.5 mt-10 -65.01 -55.53 18.41 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.45 -46.56 80.28 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 71.0 t -63.2 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 178.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.8 mtt-85 -77.83 -30.7 51.24 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.646 0.736 . . . . 0.0 109.544 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.138 -179.463 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.485 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 121.133 0.492 . . . . 0.0 110.481 . . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.579 ' CD2' ' N ' ' A' ' 20' ' ' LEU . 4.1 mm? -64.11 -38.9 92.74 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.899 -1.126 . . . . 0.0 109.139 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 77.5 tt0 -64.98 -31.26 72.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.493 -0.755 . . . . 0.0 109.613 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.536 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -59.79 -41.67 91.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.285 -0.884 . . . . 0.0 109.431 179.358 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.497 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 10.4 mp -83.67 -27.11 29.3 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.316 -0.865 . . . . 0.0 109.241 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.3 mm-40 -50.19 -27.46 5.93 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.522 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -89.44 -14.61 35.02 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.398 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' A' ' 23' ' ' LEU . 72.1 mt -83.59 -38.7 21.29 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.271 -0.893 . . . . 0.0 109.17 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.9 ttpm? -60.72 -48.07 83.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.941 . . . . 0.0 109.304 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 32' ' ' ARG . 99.2 p -54.7 -36.2 64.44 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 70.2 mm-40 -64.85 -54.96 22.82 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 178.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.88 -45.28 78.61 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.474 HG21 ' HE2' ' A' ' 27' ' ' LYS . 99.3 t -64.78 -30.63 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.0 mtt180 -76.07 -27.25 57.16 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.53 0.681 . . . . 0.0 109.545 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.427 ' N ' ' O ' ' A' ' 29' ' ' GLU . 34.0 m-70 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.996 -1.002 . . . . 0.0 109.992 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.362 0.601 . . . . 0.0 110.055 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.434 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 74.6 mt -60.7 -42.07 96.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.328 -0.858 . . . . 0.0 110.206 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 50.8 tt0 -69.43 -37.43 77.41 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.156 -0.965 . . . . 0.0 110.008 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.53 -42.75 97.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.024 -1.048 . . . . 0.0 109.638 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 26' ' ' LEU . 80.0 mt -64.64 -25.13 67.82 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.278 -0.889 . . . . 0.0 109.949 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 82.0 mt-10 -49.6 -25.78 3.07 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.076 -1.05 . . . . 0.0 108.368 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -76.36 -26.71 55.96 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.548 ' N ' ' O ' ' A' ' 23' ' ' LEU . 25.2 mt -81.95 -37.07 27.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.576 -0.702 . . . . 0.0 109.204 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.471 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.4 ttpm? -59.86 -46.31 89.69 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.423 -0.798 . . . . 0.0 109.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.2 m -56.55 -38.12 71.48 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 61.6 mm-40 -65.41 -56.6 11.59 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.11 -44.86 79.51 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.471 HG21 ' HE2' ' A' ' 27' ' ' LYS . 53.9 t -64.67 -30.49 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 28' ' ' SER . 13.5 mtp180 -76.22 -33.23 59.23 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-O 121.656 0.741 . . . . 0.0 109.334 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.226 -179.067 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.416 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.208 0.528 . . . . 0.0 109.933 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.463 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 93.0 mt -46.4 -51.19 15.49 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.241 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.472 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 67.8 tt0 -59.71 -28.33 67.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.474 -0.766 . . . . 0.0 109.617 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.521 ' O ' ' CG ' ' A' ' 25' ' ' GLU . 16.6 tp -65.39 -37.71 87.79 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.198 -0.939 . . . . 0.0 109.389 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.57 ' N ' ' CD1' ' A' ' 23' ' ' LEU . 9.0 mp -80.93 -25.84 37.15 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.255 -0.978 . . . . 0.0 108.84 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 54.0 mm-40 -50.9 -29.09 11.09 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.527 ' HG3' ' N ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -87.99 -21.01 25.07 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.527 ' N ' ' HG3' ' A' ' 25' ' ' GLU . 77.4 mt -77.05 -35.66 56.58 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.473 ' HE2' HG23 ' A' ' 31' ' ' VAL . 2.0 ttpm? -59.59 -45.62 91.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 68.7 m -57.84 -42.2 83.91 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.466 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 91.1 mt-10 -63.02 -53.93 46.11 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 178.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.0 -45.54 75.08 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.473 HG23 ' HE2' ' A' ' 27' ' ' LYS . 55.7 t -64.69 -31.98 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.7 mtt-85 -72.55 -27.36 62.16 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.497 0.665 . . . . 0.0 109.411 178.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 39.7 m-70 . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.166 -179.48 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.498 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 77.0 m . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.249 0.547 . . . . 0.0 109.842 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.527 ' O ' ' CG ' ' A' ' 24' ' ' GLU . 3.3 mp -52.14 -50.36 61.9 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.939 . . . . 0.0 109.065 179.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.435 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 60.4 tt0 -74.24 -17.19 60.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.236 -0.915 . . . . 0.0 108.854 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.498 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 3.4 tm? -75.78 -33.28 60.17 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.562 0.696 . . . . 0.0 109.315 179.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.452 ' O ' ' N ' ' A' ' 26' ' ' LEU . 3.3 pp -104.53 -12.12 16.64 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.529 -0.732 . . . . 0.0 109.902 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' A' ' 20' ' ' LEU . 3.7 mm-40 -50.58 -30.52 13.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.182 -0.948 . . . . 0.0 108.831 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -84.87 -23.0 29.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 23' ' ' LEU . 76.5 mt -80.97 -27.39 35.99 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.453 0.644 . . . . 0.0 109.446 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 11.1 ttpp -65.35 -48.99 71.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 109.629 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 32' ' ' ARG . 61.1 m -54.58 -39.62 67.99 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 33' ' ' HIS . 94.1 mt-10 -64.22 -54.51 32.32 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.64 -45.64 81.48 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 178.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.19 -28.7 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.489 ' N ' ' O ' ' A' ' 28' ' ' SER . 55.6 mtt180 -79.19 -30.71 43.54 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.679 -0.638 . . . . 0.0 109.448 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.462 ' N ' ' O ' ' A' ' 29' ' ' GLU . 23.9 m-70 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 118.146 -0.931 . . . . 0.0 110.231 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.508 ' O ' ' N ' ' A' ' 22' ' ' LEU . 1.8 m . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 120.988 0.423 . . . . 0.0 110.203 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.488 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 6.1 mp -44.27 -52.29 7.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.409 ' HA ' ' CD ' ' A' ' 24' ' ' GLU . 74.4 tt0 -61.65 -30.31 70.64 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 19' ' ' THR . 2.1 tm? -64.41 -40.77 96.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.505 -0.747 . . . . 0.0 109.558 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 26' ' ' LEU . 6.7 mp -83.34 -26.72 30.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.273 -0.892 . . . . 0.0 109.78 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 73.2 mt-10 -50.13 -23.21 2.01 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.159 -0.963 . . . . 0.0 108.465 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -85.6 -23.02 27.75 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' LEU . 57.3 mt -82.4 -34.32 28.36 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.401 -0.812 . . . . 0.0 109.02 179.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.476 ' HG2' HG23 ' A' ' 31' ' ' VAL . 11.2 ttpp -58.83 -45.69 89.41 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.237 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.488 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.7 m -58.0 -43.25 86.55 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 76.1 mm-40 -62.06 -51.83 66.4 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -48.47 78.35 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.476 HG23 ' HG2' ' A' ' 27' ' ' LYS . 53.2 t -62.38 -26.39 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 28' ' ' SER . 8.8 mtt-85 -80.35 -26.18 38.82 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.495 0.664 . . . . 0.0 109.271 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.426 ' N ' ' O ' ' A' ' 29' ' ' GLU . 30.6 m-70 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.101 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.111 0.482 . . . . 0.0 110.133 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.464 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 99.5 mt -47.52 -50.71 22.87 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.848 -1.158 . . . . 0.0 109.216 179.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 80.3 tt0 -65.11 -31.35 72.52 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.331 -0.856 . . . . 0.0 109.105 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.49 ' HB3' ' O ' ' A' ' 19' ' ' THR . 2.7 tm? -55.42 -42.67 74.44 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.35 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 26' ' ' LEU . 6.8 mp -82.74 -28.3 30.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.258 -0.901 . . . . 0.0 109.647 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 57.1 mm-40 -49.37 -24.34 1.88 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -83.24 -25.73 31.4 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 23' ' ' LEU . 71.1 mt -78.25 -37.94 43.99 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.452 ' HE2' HG22 ' A' ' 31' ' ' VAL . 2.1 ttpm? -58.35 -44.83 88.94 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 32' ' ' ARG . 70.9 m -58.22 -42.76 86.94 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.456 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 63.2 tt0 -62.06 -51.62 67.25 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.03 -46.11 82.61 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.452 HG22 ' HE2' ' A' ' 27' ' ' LYS . 51.6 t -64.33 -28.93 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 28' ' ' SER . 53.6 mtt180 -76.6 -32.69 58.24 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.59 0.709 . . . . 0.0 109.319 178.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' A' ' 29' ' ' GLU . 31.9 m-70 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.149 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.469 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 70.9 m . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.253 0.549 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 4.2 mp -47.55 -54.38 11.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.106 -0.996 . . . . 0.0 109.287 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -70.75 -20.68 62.61 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.176 -0.952 . . . . 0.0 109.178 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.469 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.3 tm? -68.01 -33.86 75.42 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.435 -0.791 . . . . 0.0 109.476 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.494 ' O ' ' N ' ' A' ' 26' ' ' LEU . 94.3 mt -99.05 -19.15 17.39 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.326 -0.859 . . . . 0.0 109.655 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.6 mm-40 -49.11 -26.9 3.02 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 108.895 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -84.05 -25.85 29.52 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' A' ' 23' ' ' LEU . 66.8 mt -81.87 -29.52 32.44 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.466 -0.771 . . . . 0.0 109.039 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.427 ' HE2' HG23 ' A' ' 31' ' ' VAL . 2.2 ttpm? -63.32 -48.0 79.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.409 -0.807 . . . . 0.0 109.365 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.468 ' O ' ' N ' ' A' ' 32' ' ' ARG . 33.0 t -55.36 -37.79 67.97 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 91.9 mt-10 -65.2 -56.39 13.1 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.11 78.78 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.427 HG23 ' HE2' ' A' ' 27' ' ' LYS . 55.7 t -64.79 -27.46 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.468 ' N ' ' O ' ' A' ' 28' ' ' SER . 10.2 mtp180 -79.12 -29.32 43.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.587 0.708 . . . . 0.0 109.199 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.233 -179.357 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.184 0.516 . . . . 0.0 110.066 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.445 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 61.0 mt -45.61 -49.6 14.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.967 -1.083 . . . . 0.0 109.243 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.503 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 42.8 tt0 -66.55 -23.66 66.25 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.0 109.129 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.51 ' N ' ' O ' ' A' ' 19' ' ' THR . 2.8 tm? -67.51 -30.66 70.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 26' ' ' LEU . 6.2 mp -95.58 -19.29 19.9 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.656 -0.653 . . . . 0.0 109.442 179.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.503 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 35.6 mt-10 -48.54 -29.1 3.87 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.349 -0.844 . . . . 0.0 108.804 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -85.19 -24.7 27.79 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.501 ' N ' ' O ' ' A' ' 23' ' ' LEU . 42.4 mt -75.84 -31.36 59.3 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.34 -0.85 . . . . 0.0 108.909 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.465 ' HE2' HG22 ' A' ' 31' ' ' VAL . 2.4 ttpm? -61.72 -48.73 79.41 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.455 -0.778 . . . . 0.0 109.08 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 65.8 m -53.39 -35.02 59.9 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.475 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 49.9 tt0 -65.71 -55.14 18.97 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.89 -45.74 85.95 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.465 HG22 ' HE2' ' A' ' 27' ' ' LYS . 41.9 t -64.71 -26.27 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.511 ' CG ' ' O ' ' A' ' 28' ' ' SER . 63.4 mtt180 -80.55 -30.37 37.09 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . 0.42 ' N ' ' O ' ' A' ' 29' ' ' GLU . 23.7 m-70 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 117.987 -1.006 . . . . 0.0 109.994 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.476 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 42.4 m . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.186 0.517 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 3.8 mp -47.18 -54.03 11.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.87 -1.144 . . . . 0.0 109.237 179.359 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 37.4 tt0 -71.65 -14.61 62.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.898 . . . . 0.0 109.291 178.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.476 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.5 tm? -78.79 -30.63 45.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 109.237 179.143 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.513 HD21 ' CD1' ' A' ' 26' ' ' LEU . 89.2 mt -101.51 -17.35 16.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.552 -0.717 . . . . 0.0 109.51 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 12.5 mm-40 -48.41 -27.51 2.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.251 -0.906 . . . . 0.0 108.726 179.25 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -84.41 -27.16 27.8 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.513 ' CD1' HD21 ' A' ' 23' ' ' LEU . 16.9 mt -78.91 -28.01 43.87 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.479 -0.763 . . . . 0.0 109.08 178.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.494 ' HG2' HG22 ' A' ' 31' ' ' VAL . 8.7 ttpp -61.46 -43.95 97.96 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.453 -0.779 . . . . 0.0 109.465 179.51 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.512 ' O ' ' N ' ' A' ' 32' ' ' ARG . 60.6 m -57.61 -41.57 81.51 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.678 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.45 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 76.9 tt0 -63.38 -51.91 63.88 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.569 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.33 81.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.913 -1.144 . . . . 0.0 107.913 178.176 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.494 HG22 ' HG2' ' A' ' 27' ' ' LYS . 97.7 t -62.77 -30.31 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.043 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' A' ' 28' ' ' SER . 60.1 mtt180 -74.91 -27.7 60.32 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.566 0.698 . . . . 0.0 109.4 179.114 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.077 -179.352 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.415 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.346 0.593 . . . . 0.0 109.999 . . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.432 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 41.9 mt -52.38 -40.34 61.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.37 -0.831 . . . . 0.0 109.674 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.461 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 75.3 tt0 -80.48 -17.63 51.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.319 179.209 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.498 ' C ' ' CD1' ' A' ' 22' ' ' LEU . 3.0 tm? -68.63 -36.15 78.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.563 -0.711 . . . . 0.0 109.828 179.809 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.498 ' O ' ' N ' ' A' ' 26' ' ' LEU . 6.1 mp -87.86 -13.42 42.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.258 -0.901 . . . . 0.0 110.208 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.461 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 74.8 mt-10 -50.5 -27.64 6.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.086 -1.009 . . . . 0.0 109.135 179.915 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 14.3 pt-20 -82.55 -22.7 34.85 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.695 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.498 ' N ' ' O ' ' A' ' 23' ' ' LEU . 84.1 mt -79.33 -32.2 43.27 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.114 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.467 ' HE2' HG23 ' A' ' 31' ' ' VAL . 1.8 ttpm? -62.23 -41.79 98.73 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.48 -0.762 . . . . 0.0 109.705 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 32' ' ' ARG . 57.0 m -53.53 -39.85 65.01 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.371 -0.83 . . . . 0.0 108.907 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.436 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 8.5 tp10 -61.61 -51.85 66.81 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.581 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.26 80.85 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.194 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.467 HG23 ' HE2' ' A' ' 27' ' ' LYS . 78.4 t -63.94 -26.97 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.208 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.2 mtt180 -78.44 -29.76 47.2 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.602 0.715 . . . . 0.0 109.389 178.876 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.8 m-70 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.22 -179.338 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.439 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.731 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.562 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.1 mt-10 -122.22 48.8 1.86 Allowed Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.212 -0.93 . . . . 0.0 110.293 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.562 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.4 Cg_endo -72.68 -34.99 6.39 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 O-C-N 124.004 1.528 . . . . 0.0 110.093 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.647 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 31.5 p90 -64.49 -33.31 75.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.393 -0.817 . . . . 0.0 110.241 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.647 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 10.8 t-20 -45.61 -49.18 14.44 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.338 -0.851 . . . . 0.0 109.994 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -69.83 -25.47 63.77 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.155 -0.966 . . . . 0.0 110.16 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.514 ' O ' ' CD2' ' A' ' 22' ' ' LEU . 40.9 t90 -76.61 -44.45 34.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.15 -0.969 . . . . 0.0 110.024 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.477 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -73.67 -47.02 42.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 109.821 179.919 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.511 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 1.3 mp -51.03 -63.23 1.2 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.137 -0.977 . . . . 0.0 109.188 179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.441 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 74.8 tt0 -56.29 -26.63 52.64 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.241 -0.912 . . . . 0.0 109.27 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.514 ' CD2' ' O ' ' A' ' 18' ' ' TRP . 1.1 mm? -68.54 -46.1 70.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.447 -0.783 . . . . 0.0 109.755 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.535 ' O ' ' N ' ' A' ' 26' ' ' LEU . 2.2 mm? -70.11 -28.11 65.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.172 -0.955 . . . . 0.0 109.46 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.485 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 88.5 mt-10 -49.83 -24.25 2.32 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -81.84 -24.93 35.55 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.535 ' N ' ' O ' ' A' ' 23' ' ' LEU . 20.7 mt -78.28 -39.44 39.97 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.438 ' HE2' HG22 ' A' ' 31' ' ' VAL . 1.6 ttpm? -60.5 -45.38 93.99 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.58 -0.7 . . . . 0.0 109.21 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 46.5 m -58.11 -41.42 83.52 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.438 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 71.1 mm-40 -63.18 -52.93 60.41 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.15 -45.4 79.64 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.438 HG22 ' HE2' ' A' ' 27' ' ' LYS . 98.7 t -64.84 -29.01 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 178.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 28' ' ' SER . 32.2 mtt-85 -76.35 -23.1 54.17 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.498 0.666 . . . . 0.0 109.533 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 42.9 m-70 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.203 -179.584 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.437 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.679 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 96.5 mt-10 -122.97 47.76 1.71 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 110.411 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.571 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 49.6 Cg_endo -74.57 -31.26 7.14 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 O-C-N 123.949 1.5 . . . . 0.0 110.172 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.572 ' CE1' ' OD1' ' A' ' 16' ' ' ASN . 43.8 p90 -67.01 -26.6 66.87 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.436 -0.79 . . . . 0.0 110.542 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.572 ' OD1' ' CE1' ' A' ' 15' ' ' TYR . 30.8 m-20 -40.13 -49.6 2.61 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.411 -0.806 . . . . 0.0 110.588 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 14' ' ' PRO . 10.5 pt-20 -74.34 -30.44 62.02 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.109 -0.994 . . . . 0.0 110.408 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 71.7 t90 -64.39 -53.89 41.43 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.13 -0.981 . . . . 0.0 110.03 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.85 -45.27 75.06 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.34 -0.85 . . . . 0.0 109.863 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.571 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 2.7 mp -61.37 -42.82 99.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.366 -0.834 . . . . 0.0 109.938 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.494 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 9.9 tp10 -66.33 -36.28 82.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.933 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -46.27 86.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.781 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.543 ' O ' ' N ' ' A' ' 26' ' ' LEU . 57.3 mt -67.24 -29.13 68.69 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.151 -0.968 . . . . 0.0 109.908 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 20.3 mm-40 -50.8 -23.82 3.03 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.036 -1.04 . . . . 0.0 108.233 179.278 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -76.0 -27.01 57.25 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.543 ' N ' ' O ' ' A' ' 23' ' ' LEU . 42.2 mt -83.82 -37.0 23.09 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.51 ' CD ' HG21 ' A' ' 31' ' ' VAL . 1.4 tmmt? -61.22 -47.21 87.15 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.521 -0.737 . . . . 0.0 109.543 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 49.3 m -56.77 -37.12 70.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.497 -0.752 . . . . 0.0 109.014 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.436 ' OE1' ' HA ' ' A' ' 26' ' ' LEU . 44.7 mt-10 -64.37 -55.56 20.27 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.45 ' O ' ' OXT' ' A' ' 33' ' ' HIS . . . -56.65 -46.24 81.16 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.51 HG21 ' CD ' ' A' ' 27' ' ' LYS . 73.6 t -64.3 -28.36 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.496 ' CG ' ' O ' ' A' ' 28' ' ' SER . 3.6 mtt180 -77.55 -28.58 51.92 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.583 0.706 . . . . 0.0 109.405 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.45 ' OXT' ' O ' ' A' ' 30' ' ' ALA . 33.3 m-70 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.056 -0.974 . . . . 0.0 110.189 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.414 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.73 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.519 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.6 mt-10 -126.18 52.85 7.95 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.909 . . . . 0.0 110.048 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.9 Cg_endo -74.66 -32.42 5.96 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 124.217 1.64 . . . . 0.0 110.03 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.565 ' CG ' ' N ' ' A' ' 16' ' ' ASN . 44.0 p90 -68.1 -43.33 78.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.645 -0.659 . . . . 0.0 110.558 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.565 ' N ' ' CG ' ' A' ' 15' ' ' TYR . 20.4 m120 44.86 82.4 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.215 -0.928 . . . . 0.0 110.754 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.487 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 79.4 mm-40 60.79 10.03 2.5 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.587 -0.696 . . . . 0.0 110.772 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.523 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 9.1 t90 -81.65 -41.2 21.76 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.107 -0.995 . . . . 0.0 109.374 179.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER -55.71 -50.42 70.38 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.353 -0.842 . . . . 0.0 109.889 179.749 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.509 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 5.9 mp -46.39 -49.5 17.85 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.082 -1.011 . . . . 0.0 109.34 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.477 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 52.7 tt0 -62.09 -19.11 62.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.357 -0.839 . . . . 0.0 109.46 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.544 ' O ' ' CG ' ' A' ' 25' ' ' GLU . 12.5 tp -80.12 -38.08 32.31 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.307 -0.871 . . . . 0.0 109.39 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.413 ' HA ' ' HB2' ' A' ' 26' ' ' LEU . 71.6 mt -77.82 -24.23 48.77 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.0 178.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.477 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 36.9 mm-40 -52.9 -26.64 15.49 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 121.218 -0.926 . . . . 0.0 108.529 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.544 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -94.11 -12.27 28.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.428 -0.795 . . . . 0.0 109.238 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 23' ' ' LEU . 78.7 mt -92.12 -28.36 17.15 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.268 -0.895 . . . . 0.0 109.009 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.461 ' NZ ' ' HB3' ' A' ' 27' ' ' LYS . 1.8 ttpm? -65.51 -34.8 79.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.495 -0.753 . . . . 0.0 109.944 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.494 ' O ' ' N ' ' A' ' 32' ' ' ARG . 91.8 p -58.41 -40.14 81.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.235 -0.916 . . . . 0.0 109.262 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.519 ' OE2' ' CD2' ' A' ' 33' ' ' HIS . 51.6 tp10 -64.26 -54.65 30.0 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -45.99 78.36 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.402 HG21 ' HG2' ' A' ' 27' ' ' LYS . 81.9 t -64.41 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.213 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 28' ' ' SER . 10.7 mtp180 -80.63 -28.33 36.99 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.559 0.695 . . . . 0.0 109.477 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.519 ' CD2' ' OE2' ' A' ' 29' ' ' GLU . 23.1 m-70 . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.207 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.406 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.671 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.569 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 98.4 mt-10 -124.27 47.64 2.0 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.129 -0.982 . . . . 0.0 110.695 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.3 Cg_endo -74.88 -26.23 11.38 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 O-C-N 123.849 1.447 . . . . 0.0 110.247 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.55 ' CE1' ' OD1' ' A' ' 16' ' ' ASN . 53.5 p90 -73.68 -33.46 64.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.867 . . . . 0.0 110.639 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.55 ' OD1' ' CE1' ' A' ' 15' ' ' TYR . 69.1 m-20 -61.42 -13.57 21.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.081 -1.012 . . . . 0.0 110.528 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -82.9 -42.43 17.72 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.117 -0.99 . . . . 0.0 110.804 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.543 ' CD2' ' N ' ' A' ' 19' ' ' THR . 65.3 p-90 -111.83 -44.1 3.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.878 -1.138 . . . . 0.0 110.43 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.543 ' N ' ' CD2' ' A' ' 18' ' ' TRP . 17.3 m -43.52 -46.14 6.84 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.249 -0.907 . . . . 0.0 109.966 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 16' ' ' ASN . 6.5 mp -51.5 -56.13 15.09 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 110.035 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 53.5 tt0 -51.86 -37.72 53.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.195 -0.941 . . . . 0.0 109.976 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.461 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 0.5 OUTLIER -64.58 -36.96 85.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.962 -1.086 . . . . 0.0 109.37 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.53 ' O ' ' N ' ' A' ' 26' ' ' LEU . 75.2 mt -75.23 -25.82 58.41 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.692 -0.803 . . . . 0.0 109.522 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.487 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 74.0 mt-10 -51.5 -23.14 3.7 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 8.9 pt-20 -82.26 -21.42 36.25 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.53 ' N ' ' O ' ' A' ' 23' ' ' LEU . 33.4 mt -89.73 -32.52 16.96 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.46 ' HE2' HG22 ' A' ' 31' ' ' VAL . 2.4 ttpm? -64.46 -40.0 94.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.497 -0.752 . . . . 0.0 110.141 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.471 ' O ' ' N ' ' A' ' 32' ' ' ARG . 79.5 p -58.43 -40.49 82.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.203 -0.936 . . . . 0.0 109.288 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.459 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 22.7 tp10 -64.25 -53.75 44.21 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.36 -44.68 76.23 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.46 HG22 ' HE2' ' A' ' 27' ' ' LYS . 74.4 t -65.8 -28.4 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' A' ' 28' ' ' SER . 10.5 mtt-85 -78.38 -24.62 46.26 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.448 0.642 . . . . 0.0 109.591 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.26 -179.482 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.413 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.75 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.584 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 60.3 mp0 -123.24 45.31 1.1 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.101 -0.999 . . . . 0.0 110.466 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 52.7 Cg_endo -75.56 -24.01 12.37 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 O-C-N 123.765 1.402 . . . . 0.0 109.954 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.5 ' CD1' ' C ' ' A' ' 15' ' ' TYR . 16.0 p90 -83.97 -22.47 31.42 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.36 -0.838 . . . . 0.0 110.525 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.526 ' HB3' ' CD1' ' A' ' 20' ' ' LEU . 14.2 m120 -51.36 -51.0 58.43 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.165 -0.959 . . . . 0.0 110.305 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -64.99 -27.34 68.76 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.172 -0.955 . . . . 0.0 110.571 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.52 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 8.3 t90 -76.38 -31.98 58.31 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.111 -0.993 . . . . 0.0 110.415 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -100.4 -43.38 6.26 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.152 -0.967 . . . . 0.0 110.142 -179.691 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.526 ' CD1' ' HB3' ' A' ' 16' ' ' ASN . 82.0 mt -47.89 -40.64 22.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.897 -1.127 . . . . 0.0 109.451 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.471 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 83.8 tt0 -66.22 -33.77 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.346 -0.847 . . . . 0.0 109.943 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.576 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -60.17 -28.72 68.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -0.949 . . . . 0.0 109.021 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.507 ' O ' ' N ' ' A' ' 26' ' ' LEU . 83.2 mt -94.84 -23.43 17.48 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.479 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 48.3 mm-40 -49.39 -32.66 11.96 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 20.9 pt-20 -80.06 -21.72 43.11 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.699 -0.801 . . . . 0.0 109.15 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.507 ' N ' ' O ' ' A' ' 23' ' ' LEU . 18.9 mt -82.46 -33.73 28.35 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.369 -0.832 . . . . 0.0 109.369 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -61.29 -47.12 87.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.382 -0.824 . . . . 0.0 109.535 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 92.7 p -56.45 -36.84 69.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.595 -0.842 . . . . 0.0 108.832 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.486 ' O ' ' N ' ' A' ' 33' ' ' HIS . 89.6 mt-10 -65.81 -55.32 17.76 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.43 -45.55 80.7 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -64.28 -27.56 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.522 ' CG ' ' O ' ' A' ' 28' ' ' SER . 9.9 mtp180 -81.77 -32.6 31.36 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.475 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.486 ' N ' ' O ' ' A' ' 29' ' ' GLU . 20.1 m-70 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.023 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.42 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.679 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 92.6 mt-10 -123.78 48.54 2.26 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 110.265 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 46.6 Cg_endo -72.47 -33.13 9.1 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.972 1.511 . . . . 0.0 110.484 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 42.1 p90 -62.88 -35.99 81.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.305 -0.872 . . . . 0.0 110.311 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.63 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 16.8 m120 -44.84 -45.38 10.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.249 -0.907 . . . . 0.0 109.582 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -70.82 -22.41 62.34 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.202 -0.936 . . . . 0.0 109.572 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.501 ' N ' ' O ' ' A' ' 15' ' ' TYR . 26.8 t90 -85.9 -40.96 15.37 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.306 -0.872 . . . . 0.0 110.182 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.479 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -77.89 -44.24 27.7 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.167 -0.958 . . . . 0.0 109.805 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.546 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 2.0 mp -55.07 -49.78 70.78 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.996 -1.065 . . . . 0.0 108.587 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.43 ' HA ' ' HB2' ' A' ' 24' ' ' GLU . 39.6 tt0 -68.22 -27.0 65.99 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.497 -0.752 . . . . 0.0 109.277 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.492 ' CD1' ' C ' ' A' ' 22' ' ' LEU . 3.1 tm? -57.27 -40.09 76.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.382 -0.824 . . . . 0.0 109.197 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.49 ' O ' ' N ' ' A' ' 26' ' ' LEU . 89.4 mt -92.23 -21.2 20.47 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.511 -0.743 . . . . 0.0 109.888 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 26.1 mm-40 -50.64 -22.38 2.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.246 -0.908 . . . . 0.0 108.906 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.414 ' OE2' ' O ' ' A' ' 22' ' ' LEU . 18.4 pt-20 -82.93 -26.93 30.95 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' A' ' 23' ' ' LEU . 54.8 mt -80.9 -34.06 33.8 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.463 -0.773 . . . . 0.0 109.105 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.492 ' HG2' HG23 ' A' ' 31' ' ' VAL . 9.5 ttpp -59.26 -46.55 88.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 109.441 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.3 m -57.7 -42.05 82.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.737 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.462 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 92.9 mt-10 -62.05 -52.72 62.8 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.31 83.38 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.492 HG23 ' HG2' ' A' ' 27' ' ' LYS . 69.2 t -62.24 -29.98 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 28' ' ' SER . 57.8 mtt180 -75.46 -28.85 59.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.559 0.695 . . . . 0.0 109.506 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.989 -179.457 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.411 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.727 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.576 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 93.2 mt-10 -123.84 47.55 1.85 Allowed Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.195 -0.94 . . . . 0.0 110.311 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.4 Cg_endo -73.65 -28.96 11.23 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 123.854 1.449 . . . . 0.0 109.947 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.57 ' CZ ' ' OD1' ' A' ' 16' ' ' ASN . 52.8 p90 -71.17 -23.84 62.13 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.324 -0.86 . . . . 0.0 110.261 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.57 ' OD1' ' CZ ' ' A' ' 15' ' ' TYR . 19.0 m120 -64.36 -15.46 60.46 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.18 -0.95 . . . . 0.0 110.493 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -81.87 -41.46 20.94 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.09 -1.006 . . . . 0.0 110.804 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.545 ' NE1' ' HA ' ' A' ' 15' ' ' TYR . 65.6 p-90 -110.62 -44.39 3.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.91 -1.119 . . . . 0.0 111.094 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.514 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 43.3 m -42.15 -53.03 4.17 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.134 -0.979 . . . . 0.0 110.049 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.47 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 7.0 mp -47.41 -52.58 16.43 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.016 -1.053 . . . . 0.0 108.466 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.462 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 84.2 tt0 -68.91 -28.02 66.29 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.507 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 3.4 tm? -65.36 -33.53 76.17 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 26' ' ' LEU . 87.3 mt -94.16 -18.22 21.96 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.535 -0.728 . . . . 0.0 109.769 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.488 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 5.7 mt-10 -51.75 -21.44 2.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.064 -1.022 . . . . 0.0 109.127 179.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -80.59 -23.57 39.76 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.425 ' N ' ' O ' ' A' ' 23' ' ' LEU . 18.7 mt -91.8 -36.77 13.35 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.517 -0.739 . . . . 0.0 109.572 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.532 ' HG3' ' N ' ' A' ' 28' ' ' SER . 13.6 pttp -60.21 -38.43 83.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 0.0 109.799 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.532 ' N ' ' HG3' ' A' ' 27' ' ' LYS . 30.0 m -67.06 -33.5 75.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.291 -0.88 . . . . 0.0 109.488 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -63.99 -55.85 19.34 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.53 76.59 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.178 -0.951 . . . . 0.0 108.555 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.453 HG21 ' O ' ' A' ' 27' ' ' LYS . 39.0 t -68.04 -28.24 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.468 ' N ' ' O ' ' A' ' 28' ' ' SER . 5.1 mtp180 -81.11 -25.28 37.08 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.546 0.688 . . . . 0.0 109.477 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.184 -179.525 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.418 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.726 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.57 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 57.1 mm-40 -123.15 46.44 1.35 Allowed Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.264 -0.898 . . . . 0.0 110.358 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 49.5 Cg_endo -74.89 -56.72 0.06 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 O-C-N 123.759 1.399 . . . . 0.0 110.282 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.536 ' O ' ' CB ' ' A' ' 18' ' ' TRP . 2.3 p90 -50.65 -29.39 10.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.355 -0.84 . . . . 0.0 110.872 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.531 ' ND2' ' O ' ' A' ' 13' ' ' GLU . 17.5 m120 40.6 69.06 0.35 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.182 -0.949 . . . . 0.0 110.11 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.481 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 80.7 mt-10 59.43 18.67 7.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.712 -0.617 . . . . 0.0 110.664 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.536 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 18.3 t90 -70.31 -43.93 69.34 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.026 -1.046 . . . . 0.0 109.72 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.45 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 3.1 m -63.03 -41.35 99.5 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.348 -0.845 . . . . 0.0 110.014 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.464 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 8.4 mp -60.97 -46.21 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.261 -0.899 . . . . 0.0 109.602 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.457 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 27.7 tt0 -62.33 -35.34 78.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.852 . . . . 0.0 109.972 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -39.9 95.14 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.176 -0.952 . . . . 0.0 109.606 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' A' ' 26' ' ' LEU . 91.9 mt -71.52 -28.3 63.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.379 -0.826 . . . . 0.0 109.937 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.464 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 95.1 mt-10 -51.09 -22.95 2.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.529 ' N ' ' O ' ' A' ' 23' ' ' LEU . 62.8 mt -82.23 -40.96 20.89 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.477 ' HE2' HG22 ' A' ' 31' ' ' VAL . 1.6 ttpm? -58.52 -44.77 89.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.515 -0.74 . . . . 0.0 109.22 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 89.9 p -58.94 -37.35 76.52 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 94.3 mt-10 -63.78 -53.04 57.09 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.11 -47.4 83.39 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.477 HG22 ' HE2' ' A' ' 27' ' ' LYS . 96.9 t -63.12 -28.41 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 28' ' ' SER . 12.7 mtt85 -76.77 -34.48 58.01 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.598 0.713 . . . . 0.0 109.435 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 117.974 -1.013 . . . . 0.0 109.899 -179.38 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.428 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.675 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.509 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 95.2 mt-10 -121.08 52.42 2.89 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.229 -0.919 . . . . 0.0 110.197 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.509 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 45.0 Cg_endo -71.24 -26.34 21.07 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 O-C-N 124.012 1.533 . . . . 0.0 110.65 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.546 ' CE1' ' OD1' ' A' ' 16' ' ' ASN . 54.3 p90 -68.71 -29.36 67.77 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.18 -0.95 . . . . 0.0 110.448 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.546 ' OD1' ' CE1' ' A' ' 15' ' ' TYR . 59.9 m-20 -61.04 -16.45 43.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.162 -0.961 . . . . 0.0 110.478 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -78.46 -40.37 35.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.166 -0.959 . . . . 0.0 110.759 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.538 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 62.5 p-90 -114.49 -37.76 4.22 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.982 -1.074 . . . . 0.0 110.597 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.493 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 60.4 m -49.69 -47.04 50.56 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.015 -1.053 . . . . 0.0 109.885 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.462 HD13 ' HA ' ' A' ' 16' ' ' ASN . 5.3 mp -51.1 -52.97 38.48 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.988 -1.07 . . . . 0.0 109.117 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.409 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 75.3 tt0 -73.78 -15.76 61.18 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.0 109.22 178.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.493 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.4 tm? -73.69 -33.69 64.53 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.429 -0.794 . . . . 0.0 109.47 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.516 ' CD2' HD13 ' A' ' 26' ' ' LEU . 34.4 mt -98.22 -19.41 17.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.49 -0.757 . . . . 0.0 109.661 179.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 11.3 mm-40 -49.14 -27.07 3.2 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.326 -0.859 . . . . 0.0 108.843 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -83.35 -22.25 32.9 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.57 -0.706 . . . . 0.0 109.319 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.516 HD13 ' CD2' ' A' ' 23' ' ' LEU . 27.8 mt -85.83 -27.98 24.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.38 -0.825 . . . . 0.0 109.277 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.439 ' HG2' HG22 ' A' ' 31' ' ' VAL . 19.4 ttpp -61.35 -47.43 85.89 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.465 -0.772 . . . . 0.0 109.35 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CD ' ' A' ' 32' ' ' ARG . 87.5 p -56.51 -38.75 72.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 32' ' ' ARG . 96.3 mt-10 -64.9 -56.47 13.12 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.2 -45.51 79.83 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.439 HG22 ' HG2' ' A' ' 27' ' ' LYS . 78.4 t -65.22 -28.27 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.522 ' CD ' ' O ' ' A' ' 28' ' ' SER . 3.7 mtp180 -79.41 -32.88 42.98 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.619 0.723 . . . . 0.0 109.384 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.432 ' N ' ' O ' ' A' ' 29' ' ' GLU . 26.4 m-70 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.156 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.425 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.756 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.526 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.8 mt-10 -121.61 50.77 2.42 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.189 -0.944 . . . . 0.0 110.634 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 44.6 Cg_endo -72.5 -29.1 13.83 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 124.038 1.546 . . . . 0.0 110.119 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.615 ' CE1' ' ND2' ' A' ' 16' ' ' ASN . 12.7 p90 -78.64 -24.12 45.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.441 -0.787 . . . . 0.0 110.201 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.615 ' ND2' ' CE1' ' A' ' 15' ' ' TYR . 26.1 m120 -63.58 -20.8 65.95 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.395 -0.816 . . . . 0.0 111.022 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -86.13 -49.65 7.6 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.933 -1.104 . . . . 0.0 111.218 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.577 ' CH2' ' OG1' ' A' ' 19' ' ' THR . 60.8 p-90 -113.86 -48.48 2.91 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.862 -1.149 . . . . 0.0 110.954 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.577 ' OG1' ' CH2' ' A' ' 18' ' ' TRP . 58.5 m -56.67 -32.77 65.73 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 120.982 -1.074 . . . . 0.0 109.579 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 15' ' ' TYR . 9.2 tp -45.28 -51.78 10.48 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.511 -0.743 . . . . 0.0 109.927 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.477 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 72.1 tt0 -67.04 -30.78 70.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.154 -0.967 . . . . 0.0 110.231 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.51 -38.3 74.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.95 -1.094 . . . . 0.0 109.641 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.506 ' O ' ' N ' ' A' ' 26' ' ' LEU . 55.0 mt -64.91 -24.23 67.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.261 -0.9 . . . . 0.0 109.844 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.477 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 95.4 mt-10 -51.42 -22.58 3.11 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.433 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -77.57 -26.16 50.62 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.506 ' N ' ' O ' ' A' ' 23' ' ' LEU . 19.6 mt -83.72 -36.99 23.26 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.412 0.625 . . . . 0.0 109.399 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.445 ' HG2' HG21 ' A' ' 31' ' ' VAL . 1.7 ttpm? -60.03 -45.69 91.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.397 -0.814 . . . . 0.0 109.44 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.477 ' O ' ' N ' ' A' ' 32' ' ' ARG . 22.6 t -56.18 -38.26 70.7 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.459 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 78.2 mt-10 -64.74 -55.1 21.96 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -44.07 77.0 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.445 HG21 ' HG2' ' A' ' 27' ' ' LYS . 41.8 t -66.15 -27.28 40.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.477 ' N ' ' O ' ' A' ' 28' ' ' SER . 36.0 mtt-85 -78.66 -34.11 46.62 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.538 0.685 . . . . 0.0 109.471 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' A' ' 29' ' ' GLU . 35.5 m-70 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.203 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.403 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.214 -0.793 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.538 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 98.4 mt-10 -125.21 49.88 3.76 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.986 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 44.3 Cg_endo -72.53 -30.73 11.89 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 124.094 1.576 . . . . 0.0 110.061 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.634 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 53.8 p90 -66.71 -44.23 82.19 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.259 -0.901 . . . . 0.0 110.1 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.634 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 22.0 m120 41.95 -87.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.614 -0.679 . . . . 0.0 111.09 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' A' ' 15' ' ' TYR . 0.1 OUTLIER -89.46 -11.4 43.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 0.0 111.249 -179.238 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.449 ' O ' HD22 ' A' ' 22' ' ' LEU . 55.4 t90 -62.84 -52.58 62.58 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.786 -1.196 . . . . 0.0 110.315 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.579 ' OG1' ' CD1' ' A' ' 15' ' ' TYR . 1.8 m -61.22 -40.82 95.43 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.056 -1.028 . . . . 0.0 109.856 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.457 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 36.1 mt -48.11 -32.9 7.45 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.14 -0.975 . . . . 0.0 109.698 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.506 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 88.0 tt0 -75.71 -26.4 57.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.319 -0.863 . . . . 0.0 109.733 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.559 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -66.53 -41.47 88.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.215 -0.928 . . . . 0.0 109.325 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.517 ' O ' ' N ' ' A' ' 26' ' ' LEU . 88.7 mt -68.92 -22.89 64.13 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.346 -0.846 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.506 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 65.6 mm-40 -50.25 -30.71 12.33 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.196 -1.001 . . . . 0.0 108.415 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -78.34 -24.32 46.57 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.517 ' N ' ' O ' ' A' ' 23' ' ' LEU . 40.8 mt -87.22 -27.72 22.8 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.603 -0.685 . . . . 0.0 109.26 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.451 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.6 ttpm? -63.91 -48.26 77.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.502 -0.749 . . . . 0.0 109.39 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 23.0 t -55.91 -38.38 70.16 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.335 -0.853 . . . . 0.0 108.878 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.406 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 71.8 mm-40 -64.39 -55.77 18.79 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.68 -44.16 81.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.488 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.451 HG21 ' HE2' ' A' ' 27' ' ' LYS . 77.2 t -66.66 -25.47 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.189 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 28' ' ' SER . 65.8 mtt180 -81.03 -22.57 39.26 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-O 121.497 0.665 . . . . 0.0 109.456 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 42.5 m-70 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.148 -179.359 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.453 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.699 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.592 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 58.7 mp0 -120.9 44.77 0.75 Allowed Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.253 -0.904 . . . . 0.0 110.651 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.5 Cg_endo -74.4 -40.94 0.97 Allowed 'Trans proline' 0 C--N 1.307 -1.637 0 O-C-N 123.785 1.413 . . . . 0.0 109.984 179.712 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 26.3 p90 -60.01 -30.04 68.89 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.365 -0.834 . . . . 0.0 110.158 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.557 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 21.2 m120 -45.84 -55.48 6.59 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.271 -0.893 . . . . 0.0 110.16 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.31 -33.26 75.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.234 -0.916 . . . . 0.0 110.28 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.454 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 37.5 t90 -70.02 -45.0 68.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.145 -0.972 . . . . 0.0 110.088 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -81.83 -52.22 7.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.147 -0.971 . . . . 0.0 110.343 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 16' ' ' ASN . 88.2 mt -44.28 -45.03 8.43 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.104 -0.997 . . . . 0.0 109.171 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.484 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 88.2 tt0 -74.5 -27.23 60.46 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.364 -0.835 . . . . 0.0 108.792 178.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.515 ' N ' ' O ' ' A' ' 19' ' ' THR . 3.4 tm? -65.48 -37.47 86.92 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.592 -0.692 . . . . 0.0 109.515 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.512 ' O ' ' N ' ' A' ' 26' ' ' LEU . 92.2 mt -92.31 -19.3 22.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.406 -0.808 . . . . 0.0 109.987 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.484 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 7.9 mm-40 -49.51 -23.76 1.75 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 108.849 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -78.57 -29.9 46.5 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 23' ' ' LEU . 63.8 mt -79.55 -33.96 41.43 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 121.577 -0.702 . . . . 0.0 109.203 179.023 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.3 ttpm? -62.8 -48.14 80.4 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.408 -0.808 . . . . 0.0 109.366 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.472 ' O ' ' N ' ' A' ' 32' ' ' ARG . 58.2 m -55.1 -36.35 65.58 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.635 -0.826 . . . . 0.0 108.906 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.445 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 95.5 mt-10 -65.01 -55.53 18.41 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.569 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.45 -46.56 80.28 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 71.0 t -63.2 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 178.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.472 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.8 mtt-85 -77.83 -30.7 51.24 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.646 0.736 . . . . 0.0 109.544 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.138 -179.463 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.431 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.702 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 92.8 mt-10 -122.43 49.63 2.29 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.0 110.148 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.3 Cg_endo -71.98 -15.58 29.28 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 O-C-N 124.053 1.554 . . . . 0.0 110.784 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.492 ' CE2' ' HA ' ' A' ' 13' ' ' GLU . 43.1 p90 -83.45 -11.79 57.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.27 -0.894 . . . . 0.0 110.75 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.49 ' O ' ' CG ' ' A' ' 20' ' ' LEU . 13.4 m120 -40.35 -26.9 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.393 -0.817 . . . . 0.0 110.435 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.477 ' N ' ' O ' ' A' ' 15' ' ' TYR . 95.4 mt-10 -112.36 -25.84 9.04 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.072 -1.018 . . . . 0.0 110.573 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.499 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 9.9 t90 -72.94 -34.94 66.87 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.157 -0.964 . . . . 0.0 110.603 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.485 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -97.89 -29.09 13.53 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.999 -1.063 . . . . 0.0 110.481 -179.537 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.579 ' N ' ' CD2' ' A' ' 20' ' ' LEU . 4.1 mm? -64.11 -38.9 92.74 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.899 -1.126 . . . . 0.0 109.139 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 77.5 tt0 -64.98 -31.26 72.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.493 -0.755 . . . . 0.0 109.613 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.536 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -59.79 -41.67 91.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.285 -0.884 . . . . 0.0 109.431 179.358 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.497 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 10.4 mp -83.67 -27.11 29.3 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.316 -0.865 . . . . 0.0 109.241 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.3 mm-40 -50.19 -27.46 5.93 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.522 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -89.44 -14.61 35.02 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.398 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' A' ' 23' ' ' LEU . 72.1 mt -83.59 -38.7 21.29 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.271 -0.893 . . . . 0.0 109.17 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.474 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.9 ttpm? -60.72 -48.07 83.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.941 . . . . 0.0 109.304 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 32' ' ' ARG . 99.2 p -54.7 -36.2 64.44 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 70.2 mm-40 -64.85 -54.96 22.82 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 178.51 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.88 -45.28 78.61 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.474 HG21 ' HE2' ' A' ' 27' ' ' LYS . 99.3 t -64.78 -30.63 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.0 mtt180 -76.07 -27.25 57.16 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.53 0.681 . . . . 0.0 109.545 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.427 ' N ' ' O ' ' A' ' 29' ' ' GLU . 34.0 m-70 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.996 -1.002 . . . . 0.0 109.992 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.467 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.711 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.583 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 90.9 mt-10 -121.41 47.1 1.2 Allowed Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.219 -0.926 . . . . 0.0 110.417 . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.5 Cg_endo -71.87 -5.02 16.23 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 123.884 1.465 . . . . 0.0 110.705 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.507 ' HA ' ' HB3' ' A' ' 18' ' ' TRP . 31.0 p90 -106.62 1.7 25.41 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.306 -0.871 . . . . 0.0 110.709 -179.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.51 ' O ' ' CD1' ' A' ' 20' ' ' LEU . 7.9 m120 -30.53 -50.15 0.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.046 0.45 . . . . 0.0 111.665 -179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.439 ' HA ' HD12 ' A' ' 20' ' ' LEU . 98.2 mt-10 -115.01 -17.39 11.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.113 -0.992 . . . . 0.0 110.807 -179.392 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.507 ' HB3' ' HA ' ' A' ' 15' ' ' TYR . 67.0 t90 -58.97 -49.84 76.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.158 -0.964 . . . . 0.0 109.969 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.457 ' OG1' ' HB2' ' A' ' 15' ' ' TYR . 0.2 OUTLIER -68.65 -36.42 78.56 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.264 -0.898 . . . . 0.0 110.055 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.51 ' CD1' ' O ' ' A' ' 16' ' ' ASN . 74.6 mt -60.7 -42.07 96.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.328 -0.858 . . . . 0.0 110.206 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.488 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 50.8 tt0 -69.43 -37.43 77.41 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.156 -0.965 . . . . 0.0 110.008 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.53 -42.75 97.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.024 -1.048 . . . . 0.0 109.638 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.548 ' O ' ' N ' ' A' ' 26' ' ' LEU . 80.0 mt -64.64 -25.13 67.82 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.278 -0.889 . . . . 0.0 109.949 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 82.0 mt-10 -49.6 -25.78 3.07 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.076 -1.05 . . . . 0.0 108.368 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -76.36 -26.71 55.96 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.548 ' N ' ' O ' ' A' ' 23' ' ' LEU . 25.2 mt -81.95 -37.07 27.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.576 -0.702 . . . . 0.0 109.204 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.471 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.4 ttpm? -59.86 -46.31 89.69 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.423 -0.798 . . . . 0.0 109.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.2 m -56.55 -38.12 71.48 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.409 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 61.6 mm-40 -65.41 -56.6 11.59 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.11 -44.86 79.51 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.471 HG21 ' HE2' ' A' ' 27' ' ' LYS . 53.9 t -64.67 -30.49 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 28' ' ' SER . 13.5 mtp180 -76.22 -33.23 59.23 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-O 121.656 0.741 . . . . 0.0 109.334 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 23.7 m-70 . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.226 -179.067 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.451 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.664 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.577 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 51.6 mt-10 -121.86 47.23 1.32 Allowed Pre-proline 0 N--CA 1.489 1.507 0 O-C-N 121.21 -0.931 . . . . 0.0 110.498 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 45.6 Cg_endo -73.02 -40.84 1.57 Allowed 'Trans proline' 0 C--N 1.307 -1.639 0 O-C-N 123.949 1.499 . . . . 0.0 110.129 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.635 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 18.2 p90 -67.41 -31.53 71.8 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.271 -0.893 . . . . 0.0 110.123 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.635 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 20.9 m120 -47.74 -53.34 15.5 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.295 -0.878 . . . . 0.0 109.706 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -62.18 -29.82 70.63 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.32 -0.863 . . . . 0.0 109.871 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -76.22 -46.76 26.72 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.263 -0.898 . . . . 0.0 110.154 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.416 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -78.24 -50.93 10.96 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.101 -0.999 . . . . 0.0 109.933 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.463 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 93.0 mt -46.4 -51.19 15.49 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.241 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.472 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 67.8 tt0 -59.71 -28.33 67.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.474 -0.766 . . . . 0.0 109.617 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.521 ' O ' ' CG ' ' A' ' 25' ' ' GLU . 16.6 tp -65.39 -37.71 87.79 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.198 -0.939 . . . . 0.0 109.389 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.57 ' CD1' ' N ' ' A' ' 23' ' ' LEU . 9.0 mp -80.93 -25.84 37.15 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.255 -0.978 . . . . 0.0 108.84 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.472 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 54.0 mm-40 -50.9 -29.09 11.09 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.753 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.527 ' HG3' ' N ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -87.99 -21.01 25.07 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.527 ' N ' ' HG3' ' A' ' 25' ' ' GLU . 77.4 mt -77.05 -35.66 56.58 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.473 ' HE2' HG23 ' A' ' 31' ' ' VAL . 2.0 ttpm? -59.59 -45.62 91.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 68.7 m -57.84 -42.2 83.91 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.466 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 91.1 mt-10 -63.02 -53.93 46.11 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 178.114 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.0 -45.54 75.08 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.193 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.473 HG23 ' HE2' ' A' ' 27' ' ' LYS . 55.7 t -64.69 -31.98 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.7 mtt-85 -72.55 -27.36 62.16 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.497 0.665 . . . . 0.0 109.411 178.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 39.7 m-70 . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.166 -179.48 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.413 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.214 -0.772 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.576 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 98.4 mt-10 -123.23 46.64 1.41 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.288 -0.883 . . . . 0.0 110.383 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.5 Cg_endo -72.83 -32.32 9.24 Favored 'Trans proline' 0 C--N 1.305 -1.714 0 O-C-N 123.939 1.494 . . . . 0.0 110.239 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.575 ' CE1' ' OD1' ' A' ' 16' ' ' ASN . 54.1 p90 -63.81 -32.27 73.72 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.303 -0.873 . . . . 0.0 109.965 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.575 ' OD1' ' CE1' ' A' ' 15' ' ' TYR . 50.2 m-20 -59.05 -17.08 22.38 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.181 -0.95 . . . . 0.0 110.089 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 90.5 mt-10 -74.84 -43.23 55.66 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.139 -0.975 . . . . 0.0 110.327 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.539 ' NE1' ' HA ' ' A' ' 15' ' ' TYR . 60.5 p-90 -111.53 -39.26 4.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.92 -1.113 . . . . 0.0 110.218 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.51 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 77.0 m -48.36 -45.14 35.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.2 -0.938 . . . . 0.0 109.842 -179.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.527 ' O ' ' CG ' ' A' ' 24' ' ' GLU . 3.3 mp -52.14 -50.36 61.9 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.939 . . . . 0.0 109.065 179.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.435 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 60.4 tt0 -74.24 -17.19 60.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.236 -0.915 . . . . 0.0 108.854 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.498 ' HB3' ' HA ' ' A' ' 19' ' ' THR . 3.4 tm? -75.78 -33.28 60.17 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.562 0.696 . . . . 0.0 109.315 179.181 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.452 ' O ' ' N ' ' A' ' 26' ' ' LEU . 3.3 pp -104.53 -12.12 16.64 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.529 -0.732 . . . . 0.0 109.902 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' A' ' 20' ' ' LEU . 3.7 mm-40 -50.58 -30.52 13.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.182 -0.948 . . . . 0.0 108.831 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -84.87 -23.0 29.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.685 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.452 ' N ' ' O ' ' A' ' 23' ' ' LEU . 76.5 mt -80.97 -27.39 35.99 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.453 0.644 . . . . 0.0 109.446 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.406 ' HE3' ' HB3' ' A' ' 27' ' ' LYS . 11.1 ttpp -65.35 -48.99 71.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 109.629 179.448 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 32' ' ' ARG . 61.1 m -54.58 -39.62 67.99 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 33' ' ' HIS . 94.1 mt-10 -64.22 -54.51 32.32 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.64 -45.64 81.48 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 178.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.19 -28.7 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.489 ' N ' ' O ' ' A' ' 28' ' ' SER . 55.6 mtt180 -79.19 -30.71 43.54 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.679 -0.638 . . . . 0.0 109.448 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.462 ' N ' ' O ' ' A' ' 29' ' ' GLU . 23.9 m-70 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 118.146 -0.931 . . . . 0.0 110.231 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.419 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.74 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.548 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.5 mt-10 -127.42 50.89 5.84 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.163 -0.96 . . . . 0.0 109.932 . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.3 Cg_endo -74.4 -58.73 0.05 OUTLIER 'Trans proline' 0 C--N 1.302 -1.876 0 O-C-N 124.153 1.607 . . . . 0.0 110.091 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.52 ' O ' ' CB ' ' A' ' 18' ' ' TRP . 2.2 p90 -44.45 -27.74 0.48 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.389 -0.82 . . . . 0.0 110.606 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 13' ' ' GLU . 18.4 m120 38.53 71.88 0.15 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.331 -0.855 . . . . 0.0 110.595 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 97.4 mt-10 58.38 19.55 6.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.589 -0.695 . . . . 0.0 110.742 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.52 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 11.4 t90 -66.91 -42.41 85.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.102 -0.998 . . . . 0.0 109.88 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.508 ' O ' ' N ' ' A' ' 22' ' ' LEU . 1.8 m -56.13 -47.24 78.52 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.128 -0.982 . . . . 0.0 110.203 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.488 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 6.1 mp -44.27 -52.29 7.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.409 ' HA ' ' CD ' ' A' ' 24' ' ' GLU . 74.4 tt0 -61.65 -30.31 70.64 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.508 ' N ' ' O ' ' A' ' 19' ' ' THR . 2.1 tm? -64.41 -40.77 96.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.505 -0.747 . . . . 0.0 109.558 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.534 ' O ' ' N ' ' A' ' 26' ' ' LEU . 6.7 mp -83.34 -26.72 30.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.273 -0.892 . . . . 0.0 109.78 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 73.2 mt-10 -50.13 -23.21 2.01 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.159 -0.963 . . . . 0.0 108.465 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -85.6 -23.02 27.75 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' LEU . 57.3 mt -82.4 -34.32 28.36 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.401 -0.812 . . . . 0.0 109.02 179.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.476 ' HG2' HG23 ' A' ' 31' ' ' VAL . 11.2 ttpp -58.83 -45.69 89.41 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.237 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.488 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.7 m -58.0 -43.25 86.55 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.452 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 76.1 mm-40 -62.06 -51.83 66.4 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.26 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -48.47 78.35 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.476 HG23 ' HG2' ' A' ' 27' ' ' LYS . 53.2 t -62.38 -26.39 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.087 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 28' ' ' SER . 8.8 mtt-85 -80.35 -26.18 38.82 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.495 0.664 . . . . 0.0 109.271 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.426 ' N ' ' O ' ' A' ' 29' ' ' GLU . 30.6 m-70 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.101 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.443 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.733 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.586 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 90.8 mt-10 -121.71 45.92 1.03 Allowed Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.142 -0.974 . . . . 0.0 110.659 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.586 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.5 Cg_endo -73.87 -32.18 7.53 Favored 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.84 1.442 . . . . 0.0 110.271 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.623 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 24.0 p90 -71.09 -32.29 68.87 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 0.0 110.437 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.623 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 25.2 m120 -46.99 -52.87 13.69 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.236 -0.915 . . . . 0.0 109.96 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -59.02 -29.33 67.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.256 -0.903 . . . . 0.0 109.952 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.445 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 15.8 t90 -77.45 -37.56 51.27 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 110.333 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -91.24 -45.39 8.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.045 -1.034 . . . . 0.0 110.133 -179.729 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.505 ' CD1' ' HB3' ' A' ' 16' ' ' ASN . 99.5 mt -47.52 -50.71 22.87 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.848 -1.158 . . . . 0.0 109.216 179.44 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.42 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 80.3 tt0 -65.11 -31.35 72.52 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.331 -0.856 . . . . 0.0 109.105 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.49 ' HB3' ' O ' ' A' ' 19' ' ' THR . 2.7 tm? -55.42 -42.67 74.44 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.35 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.521 ' O ' ' N ' ' A' ' 26' ' ' LEU . 6.8 mp -82.74 -28.3 30.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.258 -0.901 . . . . 0.0 109.647 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 57.1 mm-40 -49.37 -24.34 1.88 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -83.24 -25.73 31.4 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 23' ' ' LEU . 71.1 mt -78.25 -37.94 43.99 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.452 ' HE2' HG22 ' A' ' 31' ' ' VAL . 2.1 ttpm? -58.35 -44.83 88.94 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 32' ' ' ARG . 70.9 m -58.22 -42.76 86.94 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.456 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 63.2 tt0 -62.06 -51.62 67.25 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.484 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.03 -46.11 82.61 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.452 HG22 ' HE2' ' A' ' 27' ' ' LYS . 51.6 t -64.33 -28.93 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.049 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 28' ' ' SER . 53.6 mtt180 -76.6 -32.69 58.24 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.59 0.709 . . . . 0.0 109.319 178.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' A' ' 29' ' ' GLU . 31.9 m-70 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.149 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.436 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.214 -0.768 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.588 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 94.1 mt-10 52.08 44.59 2.15 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.453 -0.78 . . . . 0.0 110.507 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.588 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.3 Cg_endo -75.2 -27.57 9.58 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.606 1.319 . . . . 0.0 109.104 179.478 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.588 ' CE2' ' ND2' ' A' ' 16' ' ' ASN . 53.1 p90 -72.45 -29.8 64.01 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.631 -0.668 . . . . 0.0 109.966 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.588 ' ND2' ' CE2' ' A' ' 15' ' ' TYR . 29.8 m120 -61.68 -19.25 62.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.405 -0.81 . . . . 0.0 110.502 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -75.56 -39.51 58.11 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.204 -0.935 . . . . 0.0 110.818 -179.332 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.542 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 64.0 p-90 -116.14 -35.96 4.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.97 -1.082 . . . . 0.0 111.031 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.493 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 70.9 m -49.57 -49.62 45.73 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.065 -1.022 . . . . 0.0 110.042 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.465 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 4.2 mp -47.55 -54.38 11.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.106 -0.996 . . . . 0.0 109.287 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -70.75 -20.68 62.61 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.176 -0.952 . . . . 0.0 109.178 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.469 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.3 tm? -68.01 -33.86 75.42 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.435 -0.791 . . . . 0.0 109.476 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.494 ' O ' ' N ' ' A' ' 26' ' ' LEU . 94.3 mt -99.05 -19.15 17.39 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.326 -0.859 . . . . 0.0 109.655 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.6 mm-40 -49.11 -26.9 3.02 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 108.895 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -84.05 -25.85 29.52 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.494 ' N ' ' O ' ' A' ' 23' ' ' LEU . 66.8 mt -81.87 -29.52 32.44 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.466 -0.771 . . . . 0.0 109.039 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.427 ' HE2' HG23 ' A' ' 31' ' ' VAL . 2.2 ttpm? -63.32 -48.0 79.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.409 -0.807 . . . . 0.0 109.365 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.468 ' O ' ' N ' ' A' ' 32' ' ' ARG . 33.0 t -55.36 -37.79 67.97 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.446 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 91.9 mt-10 -65.2 -56.39 13.1 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.11 78.78 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.427 HG23 ' HE2' ' A' ' 27' ' ' LYS . 55.7 t -64.79 -27.46 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.468 ' N ' ' O ' ' A' ' 28' ' ' SER . 10.2 mtp180 -79.12 -29.32 43.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.587 0.708 . . . . 0.0 109.199 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 28.2 m-70 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.233 -179.357 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.424 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.718 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.552 ' HA ' ' CE2' ' A' ' 15' ' ' TYR . 73.8 mt-10 -123.14 51.67 3.9 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.241 -0.912 . . . . 0.0 109.995 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.525 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.6 Cg_endo -71.9 -31.71 12.29 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 124.164 1.612 . . . . 0.0 110.773 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.638 ' CE1' ' ND2' ' A' ' 16' ' ' ASN . 31.3 p90 -59.56 -24.11 63.45 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.3 -0.875 . . . . 0.0 110.948 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.638 ' ND2' ' CE1' ' A' ' 15' ' ' TYR . 13.4 m120 -39.97 -56.14 1.89 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.287 -0.883 . . . . 0.0 110.445 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -61.31 -26.96 68.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.302 -0.873 . . . . 0.0 110.729 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.471 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 12.3 t90 -76.23 -39.59 54.16 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.085 -1.01 . . . . 0.0 110.197 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -93.77 -45.73 7.54 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.102 -0.999 . . . . 0.0 110.066 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.514 ' CD1' ' HB3' ' A' ' 16' ' ' ASN . 61.0 mt -45.61 -49.6 14.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.967 -1.083 . . . . 0.0 109.243 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.503 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 42.8 tt0 -66.55 -23.66 66.25 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.0 109.129 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.51 ' N ' ' O ' ' A' ' 19' ' ' THR . 2.8 tm? -67.51 -30.66 70.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.054 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.501 ' O ' ' N ' ' A' ' 26' ' ' LEU . 6.2 mp -95.58 -19.29 19.9 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.656 -0.653 . . . . 0.0 109.442 179.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.503 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 35.6 mt-10 -48.54 -29.1 3.87 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.349 -0.844 . . . . 0.0 108.804 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -85.19 -24.7 27.79 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.501 ' N ' ' O ' ' A' ' 23' ' ' LEU . 42.4 mt -75.84 -31.36 59.3 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.34 -0.85 . . . . 0.0 108.909 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.465 ' HE2' HG22 ' A' ' 31' ' ' VAL . 2.4 ttpm? -61.72 -48.73 79.41 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.455 -0.778 . . . . 0.0 109.08 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 65.8 m -53.39 -35.02 59.9 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.475 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 49.9 tt0 -65.71 -55.14 18.97 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.89 -45.74 85.95 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.465 HG22 ' HE2' ' A' ' 27' ' ' LYS . 41.9 t -64.71 -26.27 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.511 ' CG ' ' O ' ' A' ' 28' ' ' SER . 63.4 mtt180 -80.55 -30.37 37.09 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.708 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . 0.42 ' N ' ' O ' ' A' ' 29' ' ' GLU . 23.7 m-70 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 117.987 -1.006 . . . . 0.0 109.994 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.421 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.662 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.563 ' HA ' ' CE2' ' A' ' 15' ' ' TYR . 97.1 mt-10 -123.05 51.61 3.78 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.262 -0.899 . . . . 0.0 110.117 . . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 46.1 Cg_endo -72.29 -28.11 15.63 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 O-C-N 123.941 1.495 . . . . 0.0 110.402 180.0 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.567 ' HA ' ' CE2' ' A' ' 18' ' ' TRP . 51.6 p90 -65.99 -31.42 72.31 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.256 -0.903 . . . . 0.0 110.518 -179.832 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.476 ' OD1' ' CE1' ' A' ' 15' ' ' TYR . 44.9 m-20 -62.35 -16.94 57.48 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.254 -0.903 . . . . 0.0 110.306 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -76.3 -38.91 55.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.302 -0.874 . . . . 0.0 110.666 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.567 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 63.1 p-90 -117.11 -39.45 3.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.957 -1.089 . . . . 0.0 110.534 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.485 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 42.4 m -49.98 -44.24 50.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.085 -1.009 . . . . 0.0 110.063 -179.756 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.462 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 3.8 mp -47.18 -54.03 11.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.87 -1.144 . . . . 0.0 109.237 179.359 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 37.4 tt0 -71.65 -14.61 62.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.898 . . . . 0.0 109.291 178.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.476 ' HB3' ' O ' ' A' ' 19' ' ' THR . 3.5 tm? -78.79 -30.63 45.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 109.237 179.143 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.513 HD21 ' CD1' ' A' ' 26' ' ' LEU . 89.2 mt -101.51 -17.35 16.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.552 -0.717 . . . . 0.0 109.51 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 12.5 mm-40 -48.41 -27.51 2.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.251 -0.906 . . . . 0.0 108.726 179.25 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -84.41 -27.16 27.8 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.872 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.513 ' CD1' HD21 ' A' ' 23' ' ' LEU . 16.9 mt -78.91 -28.01 43.87 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.479 -0.763 . . . . 0.0 109.08 178.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.494 ' HG2' HG22 ' A' ' 31' ' ' VAL . 8.7 ttpp -61.46 -43.95 97.96 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.453 -0.779 . . . . 0.0 109.465 179.51 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.512 ' O ' ' N ' ' A' ' 32' ' ' ARG . 60.6 m -57.61 -41.57 81.51 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.678 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.45 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 76.9 tt0 -63.38 -51.91 63.88 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.569 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.33 81.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.913 -1.144 . . . . 0.0 107.913 178.176 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.494 HG22 ' HG2' ' A' ' 27' ' ' LYS . 97.7 t -62.77 -30.31 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.043 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' A' ' 28' ' ' SER . 60.1 mtt180 -74.91 -27.7 60.32 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.566 0.698 . . . . 0.0 109.4 179.114 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.077 -179.352 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ACE . . . . . 0.445 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.714 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.564 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 50.4 mt-10 -122.56 48.59 1.89 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.305 -0.872 . . . . 0.0 110.238 . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.5 Cg_endo -71.95 -13.05 28.92 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.051 1.553 . . . . 0.0 110.697 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.539 ' O ' ' C ' ' A' ' 16' ' ' ASN . 29.0 p90 -88.34 -1.24 57.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.256 -0.902 . . . . 0.0 110.714 -179.539 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ASN . . . . . 0.539 ' C ' ' O ' ' A' ' 15' ' ' TYR . 12.5 m120 -22.16 -53.67 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 CA-C-O 121.129 0.49 . . . . 0.0 111.78 -179.284 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 15' ' ' TYR . 86.5 mt-10 -113.27 -10.29 13.34 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.118 -0.989 . . . . 0.0 110.429 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.466 ' HB3' ' HA ' ' A' ' 15' ' ' TYR . 62.8 t90 -61.1 -51.87 67.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.104 -0.997 . . . . 0.0 110.109 179.947 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.415 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -72.74 -37.85 67.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.314 -0.866 . . . . 0.0 109.999 -179.889 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.518 ' CD1' ' O ' ' A' ' 16' ' ' ASN . 41.9 mt -52.38 -40.34 61.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.37 -0.831 . . . . 0.0 109.674 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.461 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 75.3 tt0 -80.48 -17.63 51.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.319 179.209 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.498 ' CD1' ' C ' ' A' ' 22' ' ' LEU . 3.0 tm? -68.63 -36.15 78.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.563 -0.711 . . . . 0.0 109.828 179.809 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.498 ' O ' ' N ' ' A' ' 26' ' ' LEU . 6.1 mp -87.86 -13.42 42.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.258 -0.901 . . . . 0.0 110.208 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.461 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 74.8 mt-10 -50.5 -27.64 6.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.086 -1.009 . . . . 0.0 109.135 179.915 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.414 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 14.3 pt-20 -82.55 -22.7 34.85 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.695 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.498 ' N ' ' O ' ' A' ' 23' ' ' LEU . 84.1 mt -79.33 -32.2 43.27 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.114 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.467 ' HE2' HG23 ' A' ' 31' ' ' VAL . 1.8 ttpm? -62.23 -41.79 98.73 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.48 -0.762 . . . . 0.0 109.705 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 32' ' ' ARG . 57.0 m -53.53 -39.85 65.01 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.371 -0.83 . . . . 0.0 108.907 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.436 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 8.5 tp10 -61.61 -51.85 66.81 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.581 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.26 80.85 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.194 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.467 HG23 ' HE2' ' A' ' 27' ' ' LYS . 78.4 t -63.94 -26.97 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.208 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.2 mtt180 -78.44 -29.76 47.2 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.602 0.715 . . . . 0.0 109.389 178.876 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.8 m-70 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.22 -179.338 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.255 0.55 . . . . 0.0 109.821 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.511 ' N ' ' CD1' ' A' ' 20' ' ' LEU . 1.3 mp -51.03 -63.23 1.2 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.137 -0.977 . . . . 0.0 109.188 179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 74.8 tt0 -56.29 -26.63 52.64 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.241 -0.912 . . . . 0.0 109.27 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.516 ' HB2' ' HA ' ' A' ' 19' ' ' THR . 1.1 mm? -68.54 -46.1 70.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.447 -0.783 . . . . 0.0 109.755 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 1.096 HD13 HD12 ' A' ' 26' ' ' LEU . 2.2 mm? -70.11 -28.11 65.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.172 -0.955 . . . . 0.0 109.46 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 88.5 mt-10 -49.83 -24.25 2.32 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -81.84 -24.93 35.55 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.096 HD12 HD13 ' A' ' 23' ' ' LEU . 20.7 mt -78.28 -39.44 39.97 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.71 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.6 ttpm? -60.5 -45.38 93.99 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.58 -0.7 . . . . 0.0 109.21 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 46.5 m -58.11 -41.42 83.52 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 71.1 mm-40 -63.18 -52.93 60.41 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.15 -45.4 79.64 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 27' ' ' LYS . 98.7 t -64.84 -29.01 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 178.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.6 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 32.2 mtt-85 -76.35 -23.1 54.17 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.498 0.666 . . . . 0.0 109.533 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.6 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 22.5 m80 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.203 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.348 0.594 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.571 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 2.7 mp -61.37 -42.82 99.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.366 -0.834 . . . . 0.0 109.938 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.526 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 9.9 tp10 -66.33 -36.28 82.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.933 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -46.27 86.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.781 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.686 HD23 HD12 ' A' ' 26' ' ' LEU . 57.3 mt -67.24 -29.13 68.69 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.151 -0.968 . . . . 0.0 109.908 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.526 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 20.3 mm-40 -50.8 -23.82 3.03 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.036 -1.04 . . . . 0.0 108.233 179.278 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -76.0 -27.01 57.25 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.686 HD12 HD23 ' A' ' 23' ' ' LEU . 42.2 mt -83.82 -37.0 23.09 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.54 ' CD ' HG21 ' A' ' 31' ' ' VAL . 1.4 tmmt? -61.22 -47.21 87.15 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.521 -0.737 . . . . 0.0 109.543 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 49.3 m -56.77 -37.12 70.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.497 -0.752 . . . . 0.0 109.014 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.668 ' OE1' HD23 ' A' ' 26' ' ' LEU . 44.7 mt-10 -64.37 -55.56 20.27 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.45 ' O ' ' OXT' ' A' ' 33' ' ' HIS . . . -56.65 -46.24 81.16 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.54 HG21 ' CD ' ' A' ' 27' ' ' LYS . 73.6 t -64.3 -28.36 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.559 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 3.6 mtt180 -77.55 -28.58 51.92 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.583 0.706 . . . . 0.0 109.405 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.559 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 18.7 m80 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.056 -0.974 . . . . 0.0 110.189 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 121.248 0.547 . . . . 0.0 109.889 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.509 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 5.9 mp -46.39 -49.5 17.85 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.082 -1.011 . . . . 0.0 109.34 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.49 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 52.7 tt0 -62.09 -19.11 62.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.357 -0.839 . . . . 0.0 109.46 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.544 ' O ' ' CG ' ' A' ' 25' ' ' GLU . 12.5 tp -80.12 -38.08 32.31 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.307 -0.871 . . . . 0.0 109.39 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.957 HD23 HD12 ' A' ' 26' ' ' LEU . 71.6 mt -77.82 -24.23 48.77 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.0 178.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.49 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 36.9 mm-40 -52.9 -26.64 15.49 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 121.218 -0.926 . . . . 0.0 108.529 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.544 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -94.11 -12.27 28.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.428 -0.795 . . . . 0.0 109.238 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 HD23 ' A' ' 23' ' ' LEU . 78.7 mt -92.12 -28.36 17.15 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.268 -0.895 . . . . 0.0 109.009 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.645 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.8 ttpm? -65.51 -34.8 79.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.495 -0.753 . . . . 0.0 109.944 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.494 ' O ' ' N ' ' A' ' 32' ' ' ARG . 91.8 p -58.41 -40.14 81.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.235 -0.916 . . . . 0.0 109.262 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.551 ' OE2' ' CE1' ' A' ' 33' ' ' HIS . 51.6 tp10 -64.26 -54.65 30.0 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -45.99 78.36 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 27' ' ' LYS . 81.9 t -64.41 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.213 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.62 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 10.7 mtp180 -80.63 -28.33 36.99 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.559 0.695 . . . . 0.0 109.477 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.62 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 13.4 m80 . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.207 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 17.3 m . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.215 0.531 . . . . 0.0 109.966 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.5 mp -51.5 -56.13 15.09 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 110.035 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 53.5 tt0 -51.86 -37.72 53.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.195 -0.941 . . . . 0.0 109.976 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.448 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 0.5 OUTLIER -64.58 -36.96 85.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.962 -1.086 . . . . 0.0 109.37 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.848 HD23 HD12 ' A' ' 26' ' ' LEU . 75.2 mt -75.23 -25.82 58.41 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.692 -0.803 . . . . 0.0 109.522 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 74.0 mt-10 -51.5 -23.14 3.7 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 8.9 pt-20 -82.26 -21.42 36.25 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.848 HD12 HD23 ' A' ' 23' ' ' LEU . 33.4 mt -89.73 -32.52 16.96 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.565 ' O ' HG23 ' A' ' 31' ' ' VAL . 2.4 ttpm? -64.46 -40.0 94.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.497 -0.752 . . . . 0.0 110.141 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.471 ' O ' ' N ' ' A' ' 32' ' ' ARG . 79.5 p -58.43 -40.49 82.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.203 -0.936 . . . . 0.0 109.288 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 22.7 tp10 -64.25 -53.75 44.21 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.36 -44.68 76.23 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 27' ' ' LYS . 74.4 t -65.8 -28.4 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.58 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 10.5 mtt-85 -78.38 -24.62 46.26 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.448 0.642 . . . . 0.0 109.591 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.58 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 22.1 m80 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.26 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.183 0.516 . . . . 0.0 110.142 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 82.0 mt -47.89 -40.64 22.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.897 -1.127 . . . . 0.0 109.451 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.481 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 83.8 tt0 -66.22 -33.77 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.346 -0.847 . . . . 0.0 109.943 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.576 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -60.17 -28.72 68.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -0.949 . . . . 0.0 109.021 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 1.035 HD23 HD12 ' A' ' 26' ' ' LEU . 83.2 mt -94.84 -23.43 17.48 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 48.3 mm-40 -49.39 -32.66 11.96 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 20.9 pt-20 -80.06 -21.72 43.11 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.699 -0.801 . . . . 0.0 109.15 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.035 HD12 HD23 ' A' ' 23' ' ' LEU . 18.9 mt -82.46 -33.73 28.35 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.369 -0.832 . . . . 0.0 109.369 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -61.29 -47.12 87.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.382 -0.824 . . . . 0.0 109.535 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 92.7 p -56.45 -36.84 69.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.595 -0.842 . . . . 0.0 108.832 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 33' ' ' HIS . 89.6 mt-10 -65.81 -55.32 17.76 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.43 -45.55 80.7 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -64.28 -27.56 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.592 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 9.9 mtp180 -81.77 -32.6 31.36 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.475 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.592 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 12.0 m80 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.023 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.5 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.195 0.521 . . . . 0.0 109.805 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.546 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 2.0 mp -55.07 -49.78 70.78 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.996 -1.065 . . . . 0.0 108.587 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.491 ' HA ' ' HB2' ' A' ' 24' ' ' GLU . 39.6 tt0 -68.22 -27.0 65.99 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.497 -0.752 . . . . 0.0 109.277 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.796 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.1 tm? -57.27 -40.09 76.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.382 -0.824 . . . . 0.0 109.197 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.773 ' CD2' HD12 ' A' ' 26' ' ' LEU . 89.4 mt -92.23 -21.2 20.47 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.511 -0.743 . . . . 0.0 109.888 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 26.1 mm-40 -50.64 -22.38 2.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.246 -0.908 . . . . 0.0 108.906 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.414 ' OE2' ' O ' ' A' ' 22' ' ' LEU . 18.4 pt-20 -82.93 -26.93 30.95 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.613 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.773 HD12 ' CD2' ' A' ' 23' ' ' LEU . 54.8 mt -80.9 -34.06 33.8 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.463 -0.773 . . . . 0.0 109.105 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.502 ' O ' HG23 ' A' ' 31' ' ' VAL . 9.5 ttpp -59.26 -46.55 88.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 109.441 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.3 m -57.7 -42.05 82.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.737 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 92.9 mt-10 -62.05 -52.72 62.8 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.31 83.38 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 27' ' ' LYS . 69.2 t -62.24 -29.98 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.555 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 57.8 mtt180 -75.46 -28.85 59.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.559 0.695 . . . . 0.0 109.506 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.555 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 20.0 m80 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.989 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.594 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 43.3 m . . . . . 0 N--CA 1.495 1.818 0 CA-C-O 121.28 0.562 . . . . 0.0 110.049 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.485 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 7.0 mp -47.41 -52.58 16.43 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.016 -1.053 . . . . 0.0 108.466 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 84.2 tt0 -68.91 -28.02 66.29 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.753 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.4 tm? -65.36 -33.53 76.17 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 26' ' ' LEU . 87.3 mt -94.16 -18.22 21.96 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.535 -0.728 . . . . 0.0 109.769 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 5.7 mt-10 -51.75 -21.44 2.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.064 -1.022 . . . . 0.0 109.127 179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -80.59 -23.57 39.76 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.487 HD23 ' HA ' ' A' ' 26' ' ' LEU . 18.7 mt -91.8 -36.77 13.35 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.517 -0.739 . . . . 0.0 109.572 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.551 ' HG3' ' N ' ' A' ' 28' ' ' SER . 13.6 pttp -60.21 -38.43 83.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 0.0 109.799 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.551 ' N ' ' HG3' ' A' ' 27' ' ' LYS . 30.0 m -67.06 -33.5 75.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.291 -0.88 . . . . 0.0 109.488 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.442 ' O ' ' N ' ' A' ' 33' ' ' HIS . 95.2 mt-10 -63.99 -55.85 19.34 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.53 76.59 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.178 -0.951 . . . . 0.0 108.555 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.0 t -68.04 -28.24 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.589 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 5.1 mtp180 -81.11 -25.28 37.08 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.546 0.688 . . . . 0.0 109.477 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.589 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 17.6 m80 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.184 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.32 0.581 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.597 ' N ' HD12 ' A' ' 20' ' ' LEU . 8.4 mp -60.97 -46.21 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.261 -0.899 . . . . 0.0 109.602 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 27.7 tt0 -62.33 -35.34 78.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.852 . . . . 0.0 109.972 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -39.9 95.14 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.176 -0.952 . . . . 0.0 109.606 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 1.067 HD23 HD12 ' A' ' 26' ' ' LEU . 91.9 mt -71.52 -28.3 63.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.379 -0.826 . . . . 0.0 109.937 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 95.1 mt-10 -51.09 -22.95 2.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 1.067 HD12 HD23 ' A' ' 23' ' ' LEU . 62.8 mt -82.23 -40.96 20.89 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.6 ttpm? -58.52 -44.77 89.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.515 -0.74 . . . . 0.0 109.22 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 89.9 p -58.94 -37.35 76.52 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.519 ' OE1' HD23 ' A' ' 26' ' ' LEU . 94.3 mt-10 -63.78 -53.04 57.09 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.11 -47.4 83.39 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 27' ' ' LYS . 96.9 t -63.12 -28.41 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.504 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 12.7 mtt85 -76.77 -34.48 58.01 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.598 0.713 . . . . 0.0 109.435 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.504 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 19.0 m80 . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 117.974 -1.013 . . . . 0.0 109.899 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.573 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 60.4 m . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.136 0.494 . . . . 0.0 109.885 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 5.3 mp -51.1 -52.97 38.48 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.988 -1.07 . . . . 0.0 109.117 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -73.78 -15.76 61.18 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.0 109.22 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.725 ' C ' HD13 ' A' ' 22' ' ' LEU . 3.4 tm? -73.69 -33.69 64.53 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.429 -0.794 . . . . 0.0 109.47 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.947 HD23 HD12 ' A' ' 26' ' ' LEU . 34.4 mt -98.22 -19.41 17.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.49 -0.757 . . . . 0.0 109.661 179.309 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 11.3 mm-40 -49.14 -27.07 3.2 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.326 -0.859 . . . . 0.0 108.843 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -83.35 -22.25 32.9 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.57 -0.706 . . . . 0.0 109.319 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.947 HD12 HD23 ' A' ' 23' ' ' LEU . 27.8 mt -85.83 -27.98 24.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.38 -0.825 . . . . 0.0 109.277 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.505 ' O ' HG23 ' A' ' 31' ' ' VAL . 19.4 ttpp -61.35 -47.43 85.89 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.465 -0.772 . . . . 0.0 109.35 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CD ' ' A' ' 32' ' ' ARG . 87.5 p -56.51 -38.75 72.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.711 ' OE1' HD23 ' A' ' 26' ' ' LEU . 96.3 mt-10 -64.9 -56.47 13.12 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.2 -45.51 79.83 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 27' ' ' LYS . 78.4 t -65.22 -28.27 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.522 ' CD ' ' O ' ' A' ' 28' ' ' SER . 3.7 mtp180 -79.41 -32.88 42.98 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.619 0.723 . . . . 0.0 109.384 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.476 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 15.9 m80 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.156 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.5 m . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 121.547 0.689 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.2 tp -45.28 -51.78 10.48 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.511 -0.743 . . . . 0.0 109.927 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.494 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 72.1 tt0 -67.04 -30.78 70.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.154 -0.967 . . . . 0.0 110.231 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.51 -38.3 74.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.95 -1.094 . . . . 0.0 109.641 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.675 ' CD2' HD12 ' A' ' 26' ' ' LEU . 55.0 mt -64.91 -24.23 67.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.261 -0.9 . . . . 0.0 109.844 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 95.4 mt-10 -51.42 -22.58 3.11 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.433 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -77.57 -26.16 50.62 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.675 HD12 ' CD2' ' A' ' 23' ' ' LEU . 19.6 mt -83.72 -36.99 23.26 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.412 0.625 . . . . 0.0 109.399 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.564 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.7 ttpm? -60.03 -45.69 91.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.397 -0.814 . . . . 0.0 109.44 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.459 ' O ' ' N ' ' A' ' 32' ' ' ARG . 22.6 t -56.18 -38.26 70.7 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 78.2 mt-10 -64.74 -55.1 21.96 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -44.07 77.0 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.564 HG21 ' HE2' ' A' ' 27' ' ' LYS . 41.8 t -66.15 -27.28 40.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.488 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 36.0 mtt-85 -78.66 -34.11 46.62 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.538 0.685 . . . . 0.0 109.471 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.488 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 20.1 m80 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.203 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.489 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 1.8 m . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.279 0.561 . . . . 0.0 109.856 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 36.1 mt -48.11 -32.9 7.45 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.14 -0.975 . . . . 0.0 109.698 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.551 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 88.0 tt0 -75.71 -26.4 57.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.319 -0.863 . . . . 0.0 109.733 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.559 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -66.53 -41.47 88.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.215 -0.928 . . . . 0.0 109.325 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.901 HD23 HD12 ' A' ' 26' ' ' LEU . 88.7 mt -68.92 -22.89 64.13 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.346 -0.846 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.551 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 65.6 mm-40 -50.25 -30.71 12.33 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.196 -1.001 . . . . 0.0 108.415 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -78.34 -24.32 46.57 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.901 HD12 HD23 ' A' ' 23' ' ' LEU . 40.8 mt -87.22 -27.72 22.8 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.603 -0.685 . . . . 0.0 109.26 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.708 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.6 ttpm? -63.91 -48.26 77.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.502 -0.749 . . . . 0.0 109.39 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 23.0 t -55.91 -38.38 70.16 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.335 -0.853 . . . . 0.0 108.878 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.416 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 71.8 mm-40 -64.39 -55.77 18.79 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.68 -44.16 81.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.488 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.708 HG21 ' HE2' ' A' ' 27' ' ' LYS . 77.2 t -66.66 -25.47 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.189 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.582 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 65.8 mtt180 -81.03 -22.57 39.26 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-O 121.497 0.665 . . . . 0.0 109.456 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.582 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 22.1 m80 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.148 -179.359 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.038 0.447 . . . . 0.0 110.343 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 88.2 mt -44.28 -45.03 8.43 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.104 -0.997 . . . . 0.0 109.171 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 88.2 tt0 -74.5 -27.23 60.46 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.364 -0.835 . . . . 0.0 108.792 178.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.4 tm? -65.48 -37.47 86.92 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.592 -0.692 . . . . 0.0 109.515 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.876 HD23 HD12 ' A' ' 26' ' ' LEU . 92.2 mt -92.31 -19.3 22.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.406 -0.808 . . . . 0.0 109.987 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 7.9 mm-40 -49.51 -23.76 1.75 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 108.849 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -78.57 -29.9 46.5 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.876 HD12 HD23 ' A' ' 23' ' ' LEU . 63.8 mt -79.55 -33.96 41.43 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 121.577 -0.702 . . . . 0.0 109.203 179.023 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.489 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.3 ttpm? -62.8 -48.14 80.4 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.408 -0.808 . . . . 0.0 109.366 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.467 ' O ' ' N ' ' A' ' 32' ' ' ARG . 58.2 m -55.1 -36.35 65.58 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.635 -0.826 . . . . 0.0 108.906 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.494 ' OE1' HD23 ' A' ' 26' ' ' LEU . 95.5 mt-10 -65.01 -55.53 18.41 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.569 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.45 -46.56 80.28 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.489 HG21 ' HE2' ' A' ' 27' ' ' LYS . 71.0 t -63.2 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 178.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.54 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 40.8 mtt-85 -77.83 -30.7 51.24 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.646 0.736 . . . . 0.0 109.544 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.54 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 18.4 m80 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.138 -179.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.491 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 121.133 0.492 . . . . 0.0 110.481 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.592 ' N ' HD22 ' A' ' 20' ' ' LEU . 4.1 mm? -64.11 -38.9 92.74 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.899 -1.126 . . . . 0.0 109.139 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.411 ' HA ' ' HB2' ' A' ' 24' ' ' GLU . 77.5 tt0 -64.98 -31.26 72.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.493 -0.755 . . . . 0.0 109.613 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.536 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -59.79 -41.67 91.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.285 -0.884 . . . . 0.0 109.431 179.358 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.601 ' N ' HD12 ' A' ' 23' ' ' LEU . 10.4 mp -83.67 -27.11 29.3 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.316 -0.865 . . . . 0.0 109.241 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.3 mm-40 -50.19 -27.46 5.93 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.522 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -89.44 -14.61 35.02 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.398 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 23' ' ' LEU . 72.1 mt -83.59 -38.7 21.29 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.271 -0.893 . . . . 0.0 109.17 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.609 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.9 ttpm? -60.72 -48.07 83.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.941 . . . . 0.0 109.304 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 32' ' ' ARG . 99.2 p -54.7 -36.2 64.44 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 70.2 mm-40 -64.85 -54.96 22.82 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 178.51 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.88 -45.28 78.61 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.609 HG21 ' HE2' ' A' ' 27' ' ' LYS . 99.3 t -64.78 -30.63 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.563 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 40.0 mtt180 -76.07 -27.25 57.16 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.53 0.681 . . . . 0.0 109.545 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.563 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 19.0 m80 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.996 -1.002 . . . . 0.0 109.992 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.362 0.601 . . . . 0.0 110.055 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.451 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 74.6 mt -60.7 -42.07 96.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.328 -0.858 . . . . 0.0 110.206 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.508 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 50.8 tt0 -69.43 -37.43 77.41 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.156 -0.965 . . . . 0.0 110.008 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.53 -42.75 97.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.024 -1.048 . . . . 0.0 109.638 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.914 HD23 HD12 ' A' ' 26' ' ' LEU . 80.0 mt -64.64 -25.13 67.82 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.278 -0.889 . . . . 0.0 109.949 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.508 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 82.0 mt-10 -49.6 -25.78 3.07 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.076 -1.05 . . . . 0.0 108.368 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -76.36 -26.71 55.96 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.914 HD12 HD23 ' A' ' 23' ' ' LEU . 25.2 mt -81.95 -37.07 27.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.576 -0.702 . . . . 0.0 109.204 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.646 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.4 ttpm? -59.86 -46.31 89.69 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.423 -0.798 . . . . 0.0 109.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.2 m -56.55 -38.12 71.48 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.445 ' O ' ' N ' ' A' ' 33' ' ' HIS . 61.6 mm-40 -65.41 -56.6 11.59 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.414 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.11 -44.86 79.51 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.646 HG21 ' HE2' ' A' ' 27' ' ' LYS . 53.9 t -64.67 -30.49 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.557 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 13.5 mtp180 -76.22 -33.23 59.23 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-O 121.656 0.741 . . . . 0.0 109.334 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.557 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 14.3 m80 . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.226 -179.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.208 0.528 . . . . 0.0 109.933 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.471 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 93.0 mt -46.4 -51.19 15.49 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.241 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 67.8 tt0 -59.71 -28.33 67.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.474 -0.766 . . . . 0.0 109.617 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.531 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 16.6 tp -65.39 -37.71 87.79 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.198 -0.939 . . . . 0.0 109.389 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.636 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.0 mp -80.93 -25.84 37.15 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.255 -0.978 . . . . 0.0 108.84 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 54.0 mm-40 -50.9 -29.09 11.09 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.753 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -87.99 -21.01 25.07 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.632 HD12 ' HA ' ' A' ' 23' ' ' LEU . 77.4 mt -77.05 -35.66 56.58 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.493 ' O ' HG23 ' A' ' 31' ' ' VAL . 2.0 ttpm? -59.59 -45.62 91.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 68.7 m -57.84 -42.2 83.91 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 91.1 mt-10 -63.02 -53.93 46.11 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 178.114 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.0 -45.54 75.08 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.193 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 27' ' ' LYS . 55.7 t -64.69 -31.98 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.56 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 40.7 mtt-85 -72.55 -27.36 62.16 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.497 0.665 . . . . 0.0 109.411 178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.56 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 21.3 m80 . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.166 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.586 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 77.0 m . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.249 0.547 . . . . 0.0 109.842 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.527 ' O ' ' CG ' ' A' ' 24' ' ' GLU . 3.3 mp -52.14 -50.36 61.9 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.939 . . . . 0.0 109.065 179.548 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 60.4 tt0 -74.24 -17.19 60.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.236 -0.915 . . . . 0.0 108.854 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.734 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.4 tm? -75.78 -33.28 60.17 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.562 0.696 . . . . 0.0 109.315 179.181 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.545 HD23 HG22 ' A' ' 19' ' ' THR . 3.3 pp -104.53 -12.12 16.64 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.529 -0.732 . . . . 0.0 109.902 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' A' ' 20' ' ' LEU . 3.7 mm-40 -50.58 -30.52 13.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.182 -0.948 . . . . 0.0 108.831 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -84.87 -23.0 29.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.685 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' A' ' 23' ' ' LEU . 76.5 mt -80.97 -27.39 35.99 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.453 0.644 . . . . 0.0 109.446 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 ttpp -65.35 -48.99 71.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 109.629 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 32' ' ' ARG . 61.1 m -54.58 -39.62 67.99 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 33' ' ' HIS . 94.1 mt-10 -64.22 -54.51 32.32 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.64 -45.64 81.48 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 178.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.19 -28.7 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.557 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 55.6 mtt180 -79.19 -30.71 43.54 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.679 -0.638 . . . . 0.0 109.448 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.557 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 15.2 m80 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 118.146 -0.931 . . . . 0.0 110.231 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.508 ' O ' ' N ' ' A' ' 22' ' ' LEU . 1.8 m . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 120.988 0.423 . . . . 0.0 110.203 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.485 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 6.1 mp -44.27 -52.29 7.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -61.65 -30.31 70.64 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.809 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.1 tm? -64.41 -40.77 96.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.505 -0.747 . . . . 0.0 109.558 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.609 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.7 mp -83.34 -26.72 30.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.273 -0.892 . . . . 0.0 109.78 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 73.2 mt-10 -50.13 -23.21 2.01 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.159 -0.963 . . . . 0.0 108.465 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -85.6 -23.02 27.75 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' LEU . 57.3 mt -82.4 -34.32 28.36 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.401 -0.812 . . . . 0.0 109.02 179.135 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 31' ' ' VAL . 11.2 ttpp -58.83 -45.69 89.41 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.237 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.488 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.7 m -58.0 -43.25 86.55 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.476 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 76.1 mm-40 -62.06 -51.83 66.4 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.26 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -48.47 78.35 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 27' ' ' LYS . 53.2 t -62.38 -26.39 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.087 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.576 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 8.8 mtt-85 -80.35 -26.18 38.82 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.495 0.664 . . . . 0.0 109.271 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.576 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 17.7 m80 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.101 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.111 0.482 . . . . 0.0 110.133 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 99.5 mt -47.52 -50.71 22.87 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.848 -1.158 . . . . 0.0 109.216 179.44 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 80.3 tt0 -65.11 -31.35 72.52 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.331 -0.856 . . . . 0.0 109.105 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.7 tm? -55.42 -42.67 74.44 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.35 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.66 HD12 ' N ' ' A' ' 23' ' ' LEU . 6.8 mp -82.74 -28.3 30.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.258 -0.901 . . . . 0.0 109.647 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 57.1 mm-40 -49.37 -24.34 1.88 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -83.24 -25.73 31.4 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 23' ' ' LEU . 71.1 mt -78.25 -37.94 43.99 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.1 ttpm? -58.35 -44.83 88.94 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 32' ' ' ARG . 70.9 m -58.22 -42.76 86.94 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.502 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 63.2 tt0 -62.06 -51.62 67.25 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.484 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.03 -46.11 82.61 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.443 HG21 ' HE2' ' A' ' 27' ' ' LYS . 51.6 t -64.33 -28.93 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.049 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 28' ' ' SER . 53.6 mtt180 -76.6 -32.69 58.24 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.59 0.709 . . . . 0.0 109.319 178.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.51 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 18.2 m80 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.149 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.485 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 70.9 m . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.253 0.549 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 4.2 mp -47.55 -54.38 11.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.106 -0.996 . . . . 0.0 109.287 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -70.75 -20.68 62.61 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.176 -0.952 . . . . 0.0 109.178 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.758 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.3 tm? -68.01 -33.86 75.42 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.435 -0.791 . . . . 0.0 109.476 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.973 HD23 HD12 ' A' ' 26' ' ' LEU . 94.3 mt -99.05 -19.15 17.39 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.326 -0.859 . . . . 0.0 109.655 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.6 mm-40 -49.11 -26.9 3.02 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 108.895 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -84.05 -25.85 29.52 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.973 HD12 HD23 ' A' ' 23' ' ' LEU . 66.8 mt -81.87 -29.52 32.44 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.466 -0.771 . . . . 0.0 109.039 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.431 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.2 ttpm? -63.32 -48.0 79.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.409 -0.807 . . . . 0.0 109.365 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.468 ' O ' ' N ' ' A' ' 32' ' ' ARG . 33.0 t -55.36 -37.79 67.97 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 91.9 mt-10 -65.2 -56.39 13.1 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.11 78.78 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.431 HG21 ' HE2' ' A' ' 27' ' ' LYS . 55.7 t -64.79 -27.46 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.585 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 10.2 mtp180 -79.12 -29.32 43.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.587 0.708 . . . . 0.0 109.199 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.585 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 16.7 m80 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.233 -179.357 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.184 0.516 . . . . 0.0 110.066 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 61.0 mt -45.61 -49.6 14.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.967 -1.083 . . . . 0.0 109.243 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.513 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 42.8 tt0 -66.55 -23.66 66.25 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.0 109.129 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.944 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.8 tm? -67.51 -30.66 70.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.054 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.517 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.2 mp -95.58 -19.29 19.9 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.656 -0.653 . . . . 0.0 109.442 179.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.513 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 35.6 mt-10 -48.54 -29.1 3.87 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.349 -0.844 . . . . 0.0 108.804 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -85.19 -24.7 27.79 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.515 HD12 ' HG ' ' A' ' 23' ' ' LEU . 42.4 mt -75.84 -31.36 59.3 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.34 -0.85 . . . . 0.0 108.909 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.48 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.4 ttpm? -61.72 -48.73 79.41 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.455 -0.778 . . . . 0.0 109.08 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 65.8 m -53.39 -35.02 59.9 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 49.9 tt0 -65.71 -55.14 18.97 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.89 -45.74 85.95 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.48 HG21 ' HE2' ' A' ' 27' ' ' LYS . 41.9 t -64.71 -26.27 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.584 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 63.4 mtt180 -80.55 -30.37 37.09 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.708 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.584 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 14.3 m80 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 117.987 -1.006 . . . . 0.0 109.994 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.531 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 42.4 m . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.186 0.517 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 3.8 mp -47.18 -54.03 11.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.87 -1.144 . . . . 0.0 109.237 179.359 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 37.4 tt0 -71.65 -14.61 62.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.898 . . . . 0.0 109.291 178.913 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.807 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.5 tm? -78.79 -30.63 45.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 109.237 179.143 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.988 HD23 HD12 ' A' ' 26' ' ' LEU . 89.2 mt -101.51 -17.35 16.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.552 -0.717 . . . . 0.0 109.51 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 12.5 mm-40 -48.41 -27.51 2.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.251 -0.906 . . . . 0.0 108.726 179.25 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -84.41 -27.16 27.8 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.872 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.988 HD12 HD23 ' A' ' 23' ' ' LEU . 16.9 mt -78.91 -28.01 43.87 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.479 -0.763 . . . . 0.0 109.08 178.994 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.657 ' O ' HG23 ' A' ' 31' ' ' VAL . 8.7 ttpp -61.46 -43.95 97.96 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.453 -0.779 . . . . 0.0 109.465 179.51 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.512 ' O ' ' N ' ' A' ' 32' ' ' ARG . 60.6 m -57.61 -41.57 81.51 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.678 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.491 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 76.9 tt0 -63.38 -51.91 63.88 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.569 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.33 81.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.913 -1.144 . . . . 0.0 107.913 178.176 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 27' ' ' LYS . 97.7 t -62.77 -30.31 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.043 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.577 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 60.1 mtt180 -74.91 -27.7 60.32 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.566 0.698 . . . . 0.0 109.4 179.114 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.577 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 19.1 m80 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.077 -179.352 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.346 0.593 . . . . 0.0 109.999 . . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 41.9 mt -52.38 -40.34 61.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.37 -0.831 . . . . 0.0 109.674 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.468 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 75.3 tt0 -80.48 -17.63 51.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.319 179.209 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.877 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.0 tm? -68.63 -36.15 78.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.563 -0.711 . . . . 0.0 109.828 179.809 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.616 ' HA ' HD12 ' A' ' 26' ' ' LEU . 6.1 mp -87.86 -13.42 42.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.258 -0.901 . . . . 0.0 110.208 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.468 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 74.8 mt-10 -50.5 -27.64 6.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.086 -1.009 . . . . 0.0 109.135 179.915 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 14.3 pt-20 -82.55 -22.7 34.85 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.695 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.616 HD12 ' HA ' ' A' ' 23' ' ' LEU . 84.1 mt -79.33 -32.2 43.27 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.114 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.64 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.8 ttpm? -62.23 -41.79 98.73 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.48 -0.762 . . . . 0.0 109.705 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 32' ' ' ARG . 57.0 m -53.53 -39.85 65.01 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.371 -0.83 . . . . 0.0 108.907 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.468 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 8.5 tp10 -61.61 -51.85 66.81 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.581 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.26 80.85 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.194 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 27' ' ' LYS . 78.4 t -63.94 -26.97 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.208 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.538 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 40.2 mtt180 -78.44 -29.76 47.2 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.602 0.715 . . . . 0.0 109.389 178.876 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' HIS . . . . . 0.538 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 20.2 m80 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.22 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.47 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.731 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.562 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.1 mt-10 -122.22 48.8 1.86 Allowed Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.212 -0.93 . . . . 0.0 110.293 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.562 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.4 Cg_endo -72.68 -34.99 6.39 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 O-C-N 124.004 1.528 . . . . 0.0 110.093 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.647 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 31.5 p90 -64.49 -33.31 75.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.393 -0.817 . . . . 0.0 110.241 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.666 ' O ' HD22 ' A' ' 20' ' ' LEU . 10.8 t-20 -45.61 -49.18 14.44 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.338 -0.851 . . . . 0.0 109.994 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -69.83 -25.47 63.77 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.155 -0.966 . . . . 0.0 110.16 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.884 ' O ' HD23 ' A' ' 22' ' ' LEU . 40.9 t90 -76.61 -44.45 34.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.15 -0.969 . . . . 0.0 110.024 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -73.67 -47.02 42.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 109.821 179.919 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.666 HD22 ' O ' ' A' ' 16' ' ' ASN . 1.3 mp -51.03 -63.23 1.2 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.137 -0.977 . . . . 0.0 109.188 179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 74.8 tt0 -56.29 -26.63 52.64 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.241 -0.912 . . . . 0.0 109.27 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.884 HD23 ' O ' ' A' ' 18' ' ' TRP . 1.1 mm? -68.54 -46.1 70.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.447 -0.783 . . . . 0.0 109.755 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 1.096 HD13 HD12 ' A' ' 26' ' ' LEU . 2.2 mm? -70.11 -28.11 65.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.172 -0.955 . . . . 0.0 109.46 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 88.5 mt-10 -49.83 -24.25 2.32 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -81.84 -24.93 35.55 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.096 HD12 HD13 ' A' ' 23' ' ' LEU . 20.7 mt -78.28 -39.44 39.97 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.71 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.6 ttpm? -60.5 -45.38 93.99 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.58 -0.7 . . . . 0.0 109.21 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 46.5 m -58.11 -41.42 83.52 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 71.1 mm-40 -63.18 -52.93 60.41 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.15 -45.4 79.64 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 27' ' ' LYS . 98.7 t -64.84 -29.01 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 178.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.6 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 32.2 mtt-85 -76.35 -23.1 54.17 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.498 0.666 . . . . 0.0 109.533 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.6 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 22.5 m80 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.203 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.472 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.679 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 96.5 mt-10 -122.97 47.76 1.71 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 110.411 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.571 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 49.6 Cg_endo -74.57 -31.26 7.14 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 O-C-N 123.949 1.5 . . . . 0.0 110.172 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.572 ' CE1' ' OD1' ' A' ' 16' ' ' ASN . 43.8 p90 -67.01 -26.6 66.87 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.436 -0.79 . . . . 0.0 110.542 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.749 ' O ' HD22 ' A' ' 20' ' ' LEU . 30.8 m-20 -40.13 -49.6 2.61 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.411 -0.806 . . . . 0.0 110.588 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 14' ' ' PRO . 10.5 pt-20 -74.34 -30.44 62.02 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.109 -0.994 . . . . 0.0 110.408 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 71.7 t90 -64.39 -53.89 41.43 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.13 -0.981 . . . . 0.0 110.03 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.85 -45.27 75.06 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.34 -0.85 . . . . 0.0 109.863 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.749 HD22 ' O ' ' A' ' 16' ' ' ASN . 2.7 mp -61.37 -42.82 99.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.366 -0.834 . . . . 0.0 109.938 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.526 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 9.9 tp10 -66.33 -36.28 82.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.933 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -46.27 86.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.781 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.686 HD23 HD12 ' A' ' 26' ' ' LEU . 57.3 mt -67.24 -29.13 68.69 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.151 -0.968 . . . . 0.0 109.908 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.526 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 20.3 mm-40 -50.8 -23.82 3.03 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.036 -1.04 . . . . 0.0 108.233 179.278 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -76.0 -27.01 57.25 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.686 HD12 HD23 ' A' ' 23' ' ' LEU . 42.2 mt -83.82 -37.0 23.09 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.54 ' CD ' HG21 ' A' ' 31' ' ' VAL . 1.4 tmmt? -61.22 -47.21 87.15 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.521 -0.737 . . . . 0.0 109.543 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 49.3 m -56.77 -37.12 70.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.497 -0.752 . . . . 0.0 109.014 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.668 ' OE1' HD23 ' A' ' 26' ' ' LEU . 44.7 mt-10 -64.37 -55.56 20.27 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.45 ' O ' ' OXT' ' A' ' 33' ' ' HIS . . . -56.65 -46.24 81.16 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.54 HG21 ' CD ' ' A' ' 27' ' ' LYS . 73.6 t -64.3 -28.36 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.559 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 3.6 mtt180 -77.55 -28.58 51.92 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.583 0.706 . . . . 0.0 109.405 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.559 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 18.7 m80 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.056 -0.974 . . . . 0.0 110.189 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.443 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.73 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.519 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.6 mt-10 -126.18 52.85 7.95 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.909 . . . . 0.0 110.048 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.9 Cg_endo -74.66 -32.42 5.96 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 124.217 1.64 . . . . 0.0 110.03 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.565 ' CG ' ' N ' ' A' ' 16' ' ' ASN . 44.0 p90 -68.1 -43.33 78.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.645 -0.659 . . . . 0.0 110.558 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.565 ' N ' ' CG ' ' A' ' 15' ' ' TYR . 89.3 m-20 44.86 82.4 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.215 -0.928 . . . . 0.0 110.754 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 79.4 mm-40 60.79 10.03 2.5 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.587 -0.696 . . . . 0.0 110.772 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.523 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 9.1 t90 -81.65 -41.2 21.76 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.107 -0.995 . . . . 0.0 109.374 179.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER -55.71 -50.42 70.38 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.353 -0.842 . . . . 0.0 109.889 179.749 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.509 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 5.9 mp -46.39 -49.5 17.85 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.082 -1.011 . . . . 0.0 109.34 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.49 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 52.7 tt0 -62.09 -19.11 62.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.357 -0.839 . . . . 0.0 109.46 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.544 ' O ' ' CG ' ' A' ' 25' ' ' GLU . 12.5 tp -80.12 -38.08 32.31 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.307 -0.871 . . . . 0.0 109.39 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.957 HD23 HD12 ' A' ' 26' ' ' LEU . 71.6 mt -77.82 -24.23 48.77 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.0 178.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.49 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 36.9 mm-40 -52.9 -26.64 15.49 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 121.218 -0.926 . . . . 0.0 108.529 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.544 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -94.11 -12.27 28.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.428 -0.795 . . . . 0.0 109.238 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 HD23 ' A' ' 23' ' ' LEU . 78.7 mt -92.12 -28.36 17.15 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.268 -0.895 . . . . 0.0 109.009 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.645 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.8 ttpm? -65.51 -34.8 79.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.495 -0.753 . . . . 0.0 109.944 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.494 ' O ' ' N ' ' A' ' 32' ' ' ARG . 91.8 p -58.41 -40.14 81.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.235 -0.916 . . . . 0.0 109.262 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.551 ' OE2' ' CE1' ' A' ' 33' ' ' HIS . 51.6 tp10 -64.26 -54.65 30.0 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -45.99 78.36 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 27' ' ' LYS . 81.9 t -64.41 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.213 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.62 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 10.7 mtp180 -80.63 -28.33 36.99 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.559 0.695 . . . . 0.0 109.477 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.62 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 13.4 m80 . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.207 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.439 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.671 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.569 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 98.4 mt-10 -124.27 47.64 2.0 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.129 -0.982 . . . . 0.0 110.695 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.3 Cg_endo -74.88 -26.23 11.38 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 O-C-N 123.849 1.447 . . . . 0.0 110.247 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.55 ' CE1' ' OD1' ' A' ' 16' ' ' ASN . 53.5 p90 -73.68 -33.46 64.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.867 . . . . 0.0 110.639 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.754 ' HA ' HD13 ' A' ' 20' ' ' LEU . 69.1 m-20 -61.42 -13.57 21.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.081 -1.012 . . . . 0.0 110.528 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -82.9 -42.43 17.72 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.117 -0.99 . . . . 0.0 110.804 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.543 ' CD2' ' N ' ' A' ' 19' ' ' THR . 65.3 p-90 -111.83 -44.1 3.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.878 -1.138 . . . . 0.0 110.43 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.543 ' N ' ' CD2' ' A' ' 18' ' ' TRP . 17.3 m -43.52 -46.14 6.84 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.249 -0.907 . . . . 0.0 109.966 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.754 HD13 ' HA ' ' A' ' 16' ' ' ASN . 6.5 mp -51.5 -56.13 15.09 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 110.035 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 53.5 tt0 -51.86 -37.72 53.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.195 -0.941 . . . . 0.0 109.976 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.448 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 0.5 OUTLIER -64.58 -36.96 85.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.962 -1.086 . . . . 0.0 109.37 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.848 HD23 HD12 ' A' ' 26' ' ' LEU . 75.2 mt -75.23 -25.82 58.41 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.692 -0.803 . . . . 0.0 109.522 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 74.0 mt-10 -51.5 -23.14 3.7 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 8.9 pt-20 -82.26 -21.42 36.25 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.848 HD12 HD23 ' A' ' 23' ' ' LEU . 33.4 mt -89.73 -32.52 16.96 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.565 ' O ' HG23 ' A' ' 31' ' ' VAL . 2.4 ttpm? -64.46 -40.0 94.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.497 -0.752 . . . . 0.0 110.141 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.471 ' O ' ' N ' ' A' ' 32' ' ' ARG . 79.5 p -58.43 -40.49 82.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.203 -0.936 . . . . 0.0 109.288 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 22.7 tp10 -64.25 -53.75 44.21 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.36 -44.68 76.23 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 27' ' ' LYS . 74.4 t -65.8 -28.4 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.58 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 10.5 mtt-85 -78.38 -24.62 46.26 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.448 0.642 . . . . 0.0 109.591 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.58 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 22.1 m80 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.26 -179.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.448 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.75 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.584 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 60.3 mp0 -123.24 45.31 1.1 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.101 -0.999 . . . . 0.0 110.466 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 52.7 Cg_endo -75.56 -24.01 12.37 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 O-C-N 123.765 1.402 . . . . 0.0 109.954 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.5 ' C ' ' CD1' ' A' ' 15' ' ' TYR . 16.0 p90 -83.97 -22.47 31.42 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.36 -0.838 . . . . 0.0 110.525 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.531 ' HB3' ' CD1' ' A' ' 20' ' ' LEU . 14.2 m120 -51.36 -51.0 58.43 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.165 -0.959 . . . . 0.0 110.305 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -64.99 -27.34 68.76 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.172 -0.955 . . . . 0.0 110.571 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.52 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 8.3 t90 -76.38 -31.98 58.31 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.111 -0.993 . . . . 0.0 110.415 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -100.4 -43.38 6.26 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.152 -0.967 . . . . 0.0 110.142 -179.691 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.531 ' CD1' ' HB3' ' A' ' 16' ' ' ASN . 82.0 mt -47.89 -40.64 22.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.897 -1.127 . . . . 0.0 109.451 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.481 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 83.8 tt0 -66.22 -33.77 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.346 -0.847 . . . . 0.0 109.943 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.576 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -60.17 -28.72 68.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -0.949 . . . . 0.0 109.021 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 1.035 HD23 HD12 ' A' ' 26' ' ' LEU . 83.2 mt -94.84 -23.43 17.48 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 48.3 mm-40 -49.39 -32.66 11.96 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 20.9 pt-20 -80.06 -21.72 43.11 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.699 -0.801 . . . . 0.0 109.15 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.035 HD12 HD23 ' A' ' 23' ' ' LEU . 18.9 mt -82.46 -33.73 28.35 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.369 -0.832 . . . . 0.0 109.369 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -61.29 -47.12 87.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.382 -0.824 . . . . 0.0 109.535 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 92.7 p -56.45 -36.84 69.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.595 -0.842 . . . . 0.0 108.832 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 33' ' ' HIS . 89.6 mt-10 -65.81 -55.32 17.76 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.43 -45.55 80.7 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -64.28 -27.56 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.592 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 9.9 mtp180 -81.77 -32.6 31.36 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.475 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.592 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 12.0 m80 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.023 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.452 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.679 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 92.6 mt-10 -123.78 48.54 2.26 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 110.265 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 46.6 Cg_endo -72.47 -33.13 9.1 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.972 1.511 . . . . 0.0 110.484 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 42.1 p90 -62.88 -35.99 81.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.305 -0.872 . . . . 0.0 110.311 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.63 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 16.8 m120 -44.84 -45.38 10.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.249 -0.907 . . . . 0.0 109.582 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -70.82 -22.41 62.34 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.202 -0.936 . . . . 0.0 109.572 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.501 ' N ' ' O ' ' A' ' 15' ' ' TYR . 26.8 t90 -85.9 -40.96 15.37 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.306 -0.872 . . . . 0.0 110.182 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.5 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -77.89 -44.24 27.7 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.167 -0.958 . . . . 0.0 109.805 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.629 HD22 ' O ' ' A' ' 16' ' ' ASN . 2.0 mp -55.07 -49.78 70.78 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.996 -1.065 . . . . 0.0 108.587 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.491 ' HA ' ' HB2' ' A' ' 24' ' ' GLU . 39.6 tt0 -68.22 -27.0 65.99 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.497 -0.752 . . . . 0.0 109.277 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.796 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.1 tm? -57.27 -40.09 76.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.382 -0.824 . . . . 0.0 109.197 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.773 ' CD2' HD12 ' A' ' 26' ' ' LEU . 89.4 mt -92.23 -21.2 20.47 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.511 -0.743 . . . . 0.0 109.888 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 26.1 mm-40 -50.64 -22.38 2.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.246 -0.908 . . . . 0.0 108.906 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.414 ' OE2' ' O ' ' A' ' 22' ' ' LEU . 18.4 pt-20 -82.93 -26.93 30.95 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.773 HD12 ' CD2' ' A' ' 23' ' ' LEU . 54.8 mt -80.9 -34.06 33.8 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.463 -0.773 . . . . 0.0 109.105 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.502 ' O ' HG23 ' A' ' 31' ' ' VAL . 9.5 ttpp -59.26 -46.55 88.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 109.441 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.3 m -57.7 -42.05 82.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.737 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 92.9 mt-10 -62.05 -52.72 62.8 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.31 83.38 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 27' ' ' LYS . 69.2 t -62.24 -29.98 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.555 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 57.8 mtt180 -75.46 -28.85 59.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.559 0.695 . . . . 0.0 109.506 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.555 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 20.0 m80 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.989 -179.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.435 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.727 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.576 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 93.2 mt-10 -123.84 47.55 1.85 Allowed Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.195 -0.94 . . . . 0.0 110.311 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.4 Cg_endo -73.65 -28.96 11.23 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 123.854 1.449 . . . . 0.0 109.947 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.57 ' CZ ' ' OD1' ' A' ' 16' ' ' ASN . 52.8 p90 -71.17 -23.84 62.13 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.324 -0.86 . . . . 0.0 110.261 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.622 ' O ' HD22 ' A' ' 20' ' ' LEU . 19.0 m120 -64.36 -15.46 60.46 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.18 -0.95 . . . . 0.0 110.493 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -81.87 -41.46 20.94 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.09 -1.006 . . . . 0.0 110.804 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.566 ' NE1' ' HA ' ' A' ' 15' ' ' TYR . 65.6 p-90 -110.62 -44.39 3.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.91 -1.119 . . . . 0.0 111.094 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.594 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 43.3 m -42.15 -53.03 4.17 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.134 -0.979 . . . . 0.0 110.049 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.622 HD22 ' O ' ' A' ' 16' ' ' ASN . 7.0 mp -47.41 -52.58 16.43 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.016 -1.053 . . . . 0.0 108.466 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 84.2 tt0 -68.91 -28.02 66.29 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.753 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.4 tm? -65.36 -33.53 76.17 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 26' ' ' LEU . 87.3 mt -94.16 -18.22 21.96 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.535 -0.728 . . . . 0.0 109.769 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 5.7 mt-10 -51.75 -21.44 2.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.064 -1.022 . . . . 0.0 109.127 179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -80.59 -23.57 39.76 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.487 HD23 ' HA ' ' A' ' 26' ' ' LEU . 18.7 mt -91.8 -36.77 13.35 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.517 -0.739 . . . . 0.0 109.572 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.551 ' HG3' ' N ' ' A' ' 28' ' ' SER . 13.6 pttp -60.21 -38.43 83.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 0.0 109.799 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.551 ' N ' ' HG3' ' A' ' 27' ' ' LYS . 30.0 m -67.06 -33.5 75.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.291 -0.88 . . . . 0.0 109.488 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.442 ' O ' ' N ' ' A' ' 33' ' ' HIS . 95.2 mt-10 -63.99 -55.85 19.34 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.53 76.59 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.178 -0.951 . . . . 0.0 108.555 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.0 t -68.04 -28.24 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.589 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 5.1 mtp180 -81.11 -25.28 37.08 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.546 0.688 . . . . 0.0 109.477 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.589 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 17.6 m80 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.184 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.451 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.726 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.57 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 57.1 mm-40 -123.15 46.44 1.35 Allowed Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.264 -0.898 . . . . 0.0 110.358 . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 49.5 Cg_endo -74.89 -56.72 0.06 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 O-C-N 123.759 1.399 . . . . 0.0 110.282 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.536 ' O ' ' CB ' ' A' ' 18' ' ' TRP . 2.3 p90 -50.65 -29.39 10.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.355 -0.84 . . . . 0.0 110.872 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.476 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 82.7 m-20 40.6 69.06 0.35 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.182 -0.949 . . . . 0.0 110.11 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.476 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 80.7 mt-10 59.43 18.67 7.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.712 -0.617 . . . . 0.0 110.664 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.536 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 18.3 t90 -70.31 -43.93 69.34 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.026 -1.046 . . . . 0.0 109.72 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.45 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 3.1 m -63.03 -41.35 99.5 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.348 -0.845 . . . . 0.0 110.014 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.597 ' N ' HD12 ' A' ' 20' ' ' LEU . 8.4 mp -60.97 -46.21 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.261 -0.899 . . . . 0.0 109.602 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 27.7 tt0 -62.33 -35.34 78.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.852 . . . . 0.0 109.972 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -39.9 95.14 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.176 -0.952 . . . . 0.0 109.606 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 1.067 HD23 HD12 ' A' ' 26' ' ' LEU . 91.9 mt -71.52 -28.3 63.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.379 -0.826 . . . . 0.0 109.937 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 95.1 mt-10 -51.09 -22.95 2.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 1.067 HD12 HD23 ' A' ' 23' ' ' LEU . 62.8 mt -82.23 -40.96 20.89 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.6 ttpm? -58.52 -44.77 89.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.515 -0.74 . . . . 0.0 109.22 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 89.9 p -58.94 -37.35 76.52 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.519 ' OE1' HD23 ' A' ' 26' ' ' LEU . 94.3 mt-10 -63.78 -53.04 57.09 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.11 -47.4 83.39 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 27' ' ' LYS . 96.9 t -63.12 -28.41 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.504 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 12.7 mtt85 -76.77 -34.48 58.01 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.598 0.713 . . . . 0.0 109.435 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.504 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 19.0 m80 . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 117.974 -1.013 . . . . 0.0 109.899 -179.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.46 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.675 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.517 ' HA ' ' CE2' ' A' ' 15' ' ' TYR . 95.2 mt-10 -121.08 52.42 2.89 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.229 -0.919 . . . . 0.0 110.197 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.509 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 45.0 Cg_endo -71.24 -26.34 21.07 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 O-C-N 124.012 1.533 . . . . 0.0 110.65 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.557 ' HA ' ' CE2' ' A' ' 18' ' ' TRP . 54.3 p90 -68.71 -29.36 67.77 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.18 -0.95 . . . . 0.0 110.448 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.682 ' O ' HD22 ' A' ' 20' ' ' LEU . 59.9 m-20 -61.04 -16.45 43.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.162 -0.961 . . . . 0.0 110.478 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -78.46 -40.37 35.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.166 -0.959 . . . . 0.0 110.759 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.557 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 62.5 p-90 -114.49 -37.76 4.22 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.982 -1.074 . . . . 0.0 110.597 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.573 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 60.4 m -49.69 -47.04 50.56 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.015 -1.053 . . . . 0.0 109.885 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.682 HD22 ' O ' ' A' ' 16' ' ' ASN . 5.3 mp -51.1 -52.97 38.48 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.988 -1.07 . . . . 0.0 109.117 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -73.78 -15.76 61.18 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.0 109.22 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.725 ' C ' HD13 ' A' ' 22' ' ' LEU . 3.4 tm? -73.69 -33.69 64.53 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.429 -0.794 . . . . 0.0 109.47 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.947 HD23 HD12 ' A' ' 26' ' ' LEU . 34.4 mt -98.22 -19.41 17.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.49 -0.757 . . . . 0.0 109.661 179.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 11.3 mm-40 -49.14 -27.07 3.2 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.326 -0.859 . . . . 0.0 108.843 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -83.35 -22.25 32.9 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.57 -0.706 . . . . 0.0 109.319 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.947 HD12 HD23 ' A' ' 23' ' ' LEU . 27.8 mt -85.83 -27.98 24.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.38 -0.825 . . . . 0.0 109.277 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.505 ' O ' HG23 ' A' ' 31' ' ' VAL . 19.4 ttpp -61.35 -47.43 85.89 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.465 -0.772 . . . . 0.0 109.35 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CD ' ' A' ' 32' ' ' ARG . 87.5 p -56.51 -38.75 72.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.711 ' OE1' HD23 ' A' ' 26' ' ' LEU . 96.3 mt-10 -64.9 -56.47 13.12 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.2 -45.51 79.83 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 27' ' ' LYS . 78.4 t -65.22 -28.27 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.522 ' CD ' ' O ' ' A' ' 28' ' ' SER . 3.7 mtp180 -79.41 -32.88 42.98 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.619 0.723 . . . . 0.0 109.384 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.476 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 15.9 m80 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.156 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.456 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.756 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.526 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.8 mt-10 -121.61 50.77 2.42 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.189 -0.944 . . . . 0.0 110.634 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 44.6 Cg_endo -72.5 -29.1 13.83 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 124.038 1.546 . . . . 0.0 110.119 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.615 ' CE1' ' ND2' ' A' ' 16' ' ' ASN . 12.7 p90 -78.64 -24.12 45.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.441 -0.787 . . . . 0.0 110.201 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.615 ' ND2' ' CE1' ' A' ' 15' ' ' TYR . 26.1 m120 -63.58 -20.8 65.95 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.395 -0.816 . . . . 0.0 111.022 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -86.13 -49.65 7.6 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.933 -1.104 . . . . 0.0 111.218 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.577 ' CH2' ' OG1' ' A' ' 19' ' ' THR . 60.8 p-90 -113.86 -48.48 2.91 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.862 -1.149 . . . . 0.0 110.954 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.577 ' OG1' ' CH2' ' A' ' 18' ' ' TRP . 58.5 m -56.67 -32.77 65.73 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 120.982 -1.074 . . . . 0.0 109.579 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 15' ' ' TYR . 9.2 tp -45.28 -51.78 10.48 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.511 -0.743 . . . . 0.0 109.927 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.494 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 72.1 tt0 -67.04 -30.78 70.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.154 -0.967 . . . . 0.0 110.231 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.51 -38.3 74.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.95 -1.094 . . . . 0.0 109.641 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.675 ' CD2' HD12 ' A' ' 26' ' ' LEU . 55.0 mt -64.91 -24.23 67.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.261 -0.9 . . . . 0.0 109.844 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 95.4 mt-10 -51.42 -22.58 3.11 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.433 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -77.57 -26.16 50.62 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.675 HD12 ' CD2' ' A' ' 23' ' ' LEU . 19.6 mt -83.72 -36.99 23.26 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.412 0.625 . . . . 0.0 109.399 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.564 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.7 ttpm? -60.03 -45.69 91.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.397 -0.814 . . . . 0.0 109.44 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.459 ' O ' ' N ' ' A' ' 32' ' ' ARG . 22.6 t -56.18 -38.26 70.7 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 78.2 mt-10 -64.74 -55.1 21.96 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -44.07 77.0 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.564 HG21 ' HE2' ' A' ' 27' ' ' LYS . 41.8 t -66.15 -27.28 40.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.488 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 36.0 mtt-85 -78.66 -34.11 46.62 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.538 0.685 . . . . 0.0 109.471 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.488 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 20.1 m80 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.203 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.433 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.214 -0.793 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.538 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 98.4 mt-10 -125.21 49.88 3.76 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.986 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 44.3 Cg_endo -72.53 -30.73 11.89 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 124.094 1.576 . . . . 0.0 110.061 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.634 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 53.8 p90 -66.71 -44.23 82.19 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.259 -0.901 . . . . 0.0 110.1 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.634 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 88.5 m-20 41.95 -87.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.614 -0.679 . . . . 0.0 111.09 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' A' ' 15' ' ' TYR . 0.1 OUTLIER -89.46 -11.4 43.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 0.0 111.249 -179.238 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.443 ' CE3' ' N ' ' A' ' 19' ' ' THR . 55.4 t90 -62.84 -52.58 62.58 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.786 -1.196 . . . . 0.0 110.315 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.579 ' OG1' ' CD1' ' A' ' 15' ' ' TYR . 1.8 m -61.22 -40.82 95.43 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.056 -1.028 . . . . 0.0 109.856 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 36.1 mt -48.11 -32.9 7.45 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.14 -0.975 . . . . 0.0 109.698 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.551 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 88.0 tt0 -75.71 -26.4 57.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.319 -0.863 . . . . 0.0 109.733 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.559 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -66.53 -41.47 88.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.215 -0.928 . . . . 0.0 109.325 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.901 HD23 HD12 ' A' ' 26' ' ' LEU . 88.7 mt -68.92 -22.89 64.13 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.346 -0.846 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.551 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 65.6 mm-40 -50.25 -30.71 12.33 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.196 -1.001 . . . . 0.0 108.415 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -78.34 -24.32 46.57 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.901 HD12 HD23 ' A' ' 23' ' ' LEU . 40.8 mt -87.22 -27.72 22.8 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.603 -0.685 . . . . 0.0 109.26 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.708 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.6 ttpm? -63.91 -48.26 77.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.502 -0.749 . . . . 0.0 109.39 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 23.0 t -55.91 -38.38 70.16 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.335 -0.853 . . . . 0.0 108.878 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.416 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 71.8 mm-40 -64.39 -55.77 18.79 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.68 -44.16 81.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.488 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.708 HG21 ' HE2' ' A' ' 27' ' ' LYS . 77.2 t -66.66 -25.47 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.189 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.582 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 65.8 mtt180 -81.03 -22.57 39.26 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-O 121.497 0.665 . . . . 0.0 109.456 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.582 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 22.1 m80 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.148 -179.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.468 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.699 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.592 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 58.7 mp0 -120.9 44.77 0.75 Allowed Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.253 -0.904 . . . . 0.0 110.651 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.5 Cg_endo -74.4 -40.94 0.97 Allowed 'Trans proline' 0 C--N 1.307 -1.637 0 O-C-N 123.785 1.413 . . . . 0.0 109.984 179.712 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 26.3 p90 -60.01 -30.04 68.89 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.365 -0.834 . . . . 0.0 110.158 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.557 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 21.2 m120 -45.84 -55.48 6.59 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.271 -0.893 . . . . 0.0 110.16 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.31 -33.26 75.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.234 -0.916 . . . . 0.0 110.28 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.468 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 37.5 t90 -70.02 -45.0 68.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.145 -0.972 . . . . 0.0 110.088 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -81.83 -52.22 7.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.147 -0.971 . . . . 0.0 110.343 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 88.2 mt -44.28 -45.03 8.43 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.104 -0.997 . . . . 0.0 109.171 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 88.2 tt0 -74.5 -27.23 60.46 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.364 -0.835 . . . . 0.0 108.792 178.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.4 tm? -65.48 -37.47 86.92 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.592 -0.692 . . . . 0.0 109.515 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.876 HD23 HD12 ' A' ' 26' ' ' LEU . 92.2 mt -92.31 -19.3 22.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.406 -0.808 . . . . 0.0 109.987 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 7.9 mm-40 -49.51 -23.76 1.75 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 108.849 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -78.57 -29.9 46.5 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.876 HD12 HD23 ' A' ' 23' ' ' LEU . 63.8 mt -79.55 -33.96 41.43 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 121.577 -0.702 . . . . 0.0 109.203 179.023 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.489 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.3 ttpm? -62.8 -48.14 80.4 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.408 -0.808 . . . . 0.0 109.366 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.467 ' O ' ' N ' ' A' ' 32' ' ' ARG . 58.2 m -55.1 -36.35 65.58 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.635 -0.826 . . . . 0.0 108.906 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.494 ' OE1' HD23 ' A' ' 26' ' ' LEU . 95.5 mt-10 -65.01 -55.53 18.41 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.569 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.45 -46.56 80.28 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.489 HG21 ' HE2' ' A' ' 27' ' ' LYS . 71.0 t -63.2 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 178.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.54 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 40.8 mtt-85 -77.83 -30.7 51.24 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.646 0.736 . . . . 0.0 109.544 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.54 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 18.4 m80 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.138 -179.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.464 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.702 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 92.8 mt-10 -122.43 49.63 2.29 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.0 110.148 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.3 Cg_endo -71.98 -15.58 29.28 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 O-C-N 124.053 1.554 . . . . 0.0 110.784 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.516 ' CE2' ' HA ' ' A' ' 13' ' ' GLU . 43.1 p90 -83.45 -11.79 57.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.27 -0.894 . . . . 0.0 110.75 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.499 ' OD1' ' HB3' ' A' ' 13' ' ' GLU . 13.4 m120 -40.35 -26.9 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.393 -0.817 . . . . 0.0 110.435 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.477 ' N ' ' O ' ' A' ' 15' ' ' TYR . 95.4 mt-10 -112.36 -25.84 9.04 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.072 -1.018 . . . . 0.0 110.573 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.499 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 9.9 t90 -72.94 -34.94 66.87 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.157 -0.964 . . . . 0.0 110.603 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.491 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -97.89 -29.09 13.53 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.999 -1.063 . . . . 0.0 110.481 -179.537 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.592 ' N ' HD22 ' A' ' 20' ' ' LEU . 4.1 mm? -64.11 -38.9 92.74 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.899 -1.126 . . . . 0.0 109.139 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.411 ' HA ' ' HB2' ' A' ' 24' ' ' GLU . 77.5 tt0 -64.98 -31.26 72.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.493 -0.755 . . . . 0.0 109.613 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.536 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -59.79 -41.67 91.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.285 -0.884 . . . . 0.0 109.431 179.358 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.601 ' N ' HD12 ' A' ' 23' ' ' LEU . 10.4 mp -83.67 -27.11 29.3 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.316 -0.865 . . . . 0.0 109.241 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.3 mm-40 -50.19 -27.46 5.93 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.522 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -89.44 -14.61 35.02 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.398 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 23' ' ' LEU . 72.1 mt -83.59 -38.7 21.29 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.271 -0.893 . . . . 0.0 109.17 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.609 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.9 ttpm? -60.72 -48.07 83.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.941 . . . . 0.0 109.304 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 32' ' ' ARG . 99.2 p -54.7 -36.2 64.44 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 70.2 mm-40 -64.85 -54.96 22.82 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 178.51 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.88 -45.28 78.61 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.609 HG21 ' HE2' ' A' ' 27' ' ' LYS . 99.3 t -64.78 -30.63 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.563 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 40.0 mtt180 -76.07 -27.25 57.16 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.53 0.681 . . . . 0.0 109.545 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.563 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 19.0 m80 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.996 -1.002 . . . . 0.0 109.992 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.467 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.711 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.583 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 90.9 mt-10 -121.41 47.1 1.2 Allowed Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.219 -0.926 . . . . 0.0 110.417 . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.5 Cg_endo -71.87 -5.02 16.23 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 123.884 1.465 . . . . 0.0 110.705 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.566 ' HA ' ' HB3' ' A' ' 18' ' ' TRP . 31.0 p90 -106.62 1.7 25.41 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.306 -0.871 . . . . 0.0 110.709 -179.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.51 ' O ' ' CD1' ' A' ' 20' ' ' LEU . 7.9 m120 -30.53 -50.15 0.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.046 0.45 . . . . 0.0 111.665 -179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.492 ' HA ' HD12 ' A' ' 20' ' ' LEU . 98.2 mt-10 -115.01 -17.39 11.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.113 -0.992 . . . . 0.0 110.807 -179.392 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.566 ' HB3' ' HA ' ' A' ' 15' ' ' TYR . 67.0 t90 -58.97 -49.84 76.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.158 -0.964 . . . . 0.0 109.969 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.457 ' OG1' ' HB2' ' A' ' 15' ' ' TYR . 0.2 OUTLIER -68.65 -36.42 78.56 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.264 -0.898 . . . . 0.0 110.055 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.51 ' CD1' ' O ' ' A' ' 16' ' ' ASN . 74.6 mt -60.7 -42.07 96.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.328 -0.858 . . . . 0.0 110.206 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.508 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 50.8 tt0 -69.43 -37.43 77.41 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.156 -0.965 . . . . 0.0 110.008 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.53 -42.75 97.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.024 -1.048 . . . . 0.0 109.638 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.914 HD23 HD12 ' A' ' 26' ' ' LEU . 80.0 mt -64.64 -25.13 67.82 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.278 -0.889 . . . . 0.0 109.949 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.508 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 82.0 mt-10 -49.6 -25.78 3.07 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.076 -1.05 . . . . 0.0 108.368 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -76.36 -26.71 55.96 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.914 HD12 HD23 ' A' ' 23' ' ' LEU . 25.2 mt -81.95 -37.07 27.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.576 -0.702 . . . . 0.0 109.204 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.646 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.4 ttpm? -59.86 -46.31 89.69 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.423 -0.798 . . . . 0.0 109.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.2 m -56.55 -38.12 71.48 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.445 ' O ' ' N ' ' A' ' 33' ' ' HIS . 61.6 mm-40 -65.41 -56.6 11.59 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.11 -44.86 79.51 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.646 HG21 ' HE2' ' A' ' 27' ' ' LYS . 53.9 t -64.67 -30.49 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.557 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 13.5 mtp180 -76.22 -33.23 59.23 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-O 121.656 0.741 . . . . 0.0 109.334 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.557 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 14.3 m80 . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.226 -179.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.464 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.664 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.577 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 51.6 mt-10 -121.86 47.23 1.32 Allowed Pre-proline 0 N--CA 1.489 1.507 0 O-C-N 121.21 -0.931 . . . . 0.0 110.498 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 45.6 Cg_endo -73.02 -40.84 1.57 Allowed 'Trans proline' 0 C--N 1.307 -1.639 0 O-C-N 123.949 1.499 . . . . 0.0 110.129 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.635 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 18.2 p90 -67.41 -31.53 71.8 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.271 -0.893 . . . . 0.0 110.123 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.635 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 20.9 m120 -47.74 -53.34 15.5 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.295 -0.878 . . . . 0.0 109.706 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -62.18 -29.82 70.63 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.32 -0.863 . . . . 0.0 109.871 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -76.22 -46.76 26.72 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.263 -0.898 . . . . 0.0 110.154 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -78.24 -50.93 10.96 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.101 -0.999 . . . . 0.0 109.933 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.471 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 93.0 mt -46.4 -51.19 15.49 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.241 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 67.8 tt0 -59.71 -28.33 67.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.474 -0.766 . . . . 0.0 109.617 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.531 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 16.6 tp -65.39 -37.71 87.79 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.198 -0.939 . . . . 0.0 109.389 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.636 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.0 mp -80.93 -25.84 37.15 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.255 -0.978 . . . . 0.0 108.84 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 54.0 mm-40 -50.9 -29.09 11.09 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.753 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -87.99 -21.01 25.07 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.632 HD12 ' HA ' ' A' ' 23' ' ' LEU . 77.4 mt -77.05 -35.66 56.58 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.493 ' O ' HG23 ' A' ' 31' ' ' VAL . 2.0 ttpm? -59.59 -45.62 91.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 68.7 m -57.84 -42.2 83.91 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 91.1 mt-10 -63.02 -53.93 46.11 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 178.114 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.0 -45.54 75.08 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.193 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 27' ' ' LYS . 55.7 t -64.69 -31.98 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.56 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 40.7 mtt-85 -72.55 -27.36 62.16 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.497 0.665 . . . . 0.0 109.411 178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.56 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 21.3 m80 . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.166 -179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.426 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.214 -0.772 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.576 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 98.4 mt-10 -123.23 46.64 1.41 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.288 -0.883 . . . . 0.0 110.383 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.5 Cg_endo -72.83 -32.32 9.24 Favored 'Trans proline' 0 C--N 1.305 -1.714 0 O-C-N 123.939 1.494 . . . . 0.0 110.239 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.575 ' CE1' ' OD1' ' A' ' 16' ' ' ASN . 54.1 p90 -63.81 -32.27 73.72 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.303 -0.873 . . . . 0.0 109.965 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.872 ' O ' HD22 ' A' ' 20' ' ' LEU . 50.2 m-20 -59.05 -17.08 22.38 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.181 -0.95 . . . . 0.0 110.089 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 90.5 mt-10 -74.84 -43.23 55.66 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.139 -0.975 . . . . 0.0 110.327 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.557 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 60.5 p-90 -111.53 -39.26 4.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.92 -1.113 . . . . 0.0 110.218 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.586 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 77.0 m -48.36 -45.14 35.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.2 -0.938 . . . . 0.0 109.842 -179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.872 HD22 ' O ' ' A' ' 16' ' ' ASN . 3.3 mp -52.14 -50.36 61.9 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.939 . . . . 0.0 109.065 179.548 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 60.4 tt0 -74.24 -17.19 60.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.236 -0.915 . . . . 0.0 108.854 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.734 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.4 tm? -75.78 -33.28 60.17 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.562 0.696 . . . . 0.0 109.315 179.181 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.545 HD23 HG22 ' A' ' 19' ' ' THR . 3.3 pp -104.53 -12.12 16.64 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.529 -0.732 . . . . 0.0 109.902 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' A' ' 20' ' ' LEU . 3.7 mm-40 -50.58 -30.52 13.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.182 -0.948 . . . . 0.0 108.831 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -84.87 -23.0 29.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.685 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' A' ' 23' ' ' LEU . 76.5 mt -80.97 -27.39 35.99 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.453 0.644 . . . . 0.0 109.446 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 ttpp -65.35 -48.99 71.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 109.629 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 32' ' ' ARG . 61.1 m -54.58 -39.62 67.99 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 33' ' ' HIS . 94.1 mt-10 -64.22 -54.51 32.32 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.64 -45.64 81.48 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 178.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.19 -28.7 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.557 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 55.6 mtt180 -79.19 -30.71 43.54 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.679 -0.638 . . . . 0.0 109.448 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.557 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 15.2 m80 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 118.146 -0.931 . . . . 0.0 110.231 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.452 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.74 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.548 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.5 mt-10 -127.42 50.89 5.84 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.163 -0.96 . . . . 0.0 109.932 . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.3 Cg_endo -74.4 -58.73 0.05 OUTLIER 'Trans proline' 0 C--N 1.302 -1.876 0 O-C-N 124.153 1.607 . . . . 0.0 110.091 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.52 ' O ' ' CB ' ' A' ' 18' ' ' TRP . 2.2 p90 -44.45 -27.74 0.48 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.389 -0.82 . . . . 0.0 110.606 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.466 ' O ' ' HB2' ' A' ' 17' ' ' GLU . 81.1 m-20 38.53 71.88 0.15 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.331 -0.855 . . . . 0.0 110.595 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 97.4 mt-10 58.38 19.55 6.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.589 -0.695 . . . . 0.0 110.742 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.52 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 11.4 t90 -66.91 -42.41 85.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.102 -0.998 . . . . 0.0 109.88 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.508 ' O ' ' N ' ' A' ' 22' ' ' LEU . 1.8 m -56.13 -47.24 78.52 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.128 -0.982 . . . . 0.0 110.203 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.485 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 6.1 mp -44.27 -52.29 7.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -61.65 -30.31 70.64 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.809 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.1 tm? -64.41 -40.77 96.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.505 -0.747 . . . . 0.0 109.558 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.609 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.7 mp -83.34 -26.72 30.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.273 -0.892 . . . . 0.0 109.78 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 73.2 mt-10 -50.13 -23.21 2.01 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.159 -0.963 . . . . 0.0 108.465 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -85.6 -23.02 27.75 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' LEU . 57.3 mt -82.4 -34.32 28.36 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.401 -0.812 . . . . 0.0 109.02 179.135 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 31' ' ' VAL . 11.2 ttpp -58.83 -45.69 89.41 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.237 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.488 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.7 m -58.0 -43.25 86.55 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.476 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 76.1 mm-40 -62.06 -51.83 66.4 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.26 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -48.47 78.35 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 27' ' ' LYS . 53.2 t -62.38 -26.39 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.087 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.576 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 8.8 mtt-85 -80.35 -26.18 38.82 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.495 0.664 . . . . 0.0 109.271 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.576 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 17.7 m80 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.101 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.465 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.733 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.586 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 90.8 mt-10 -121.71 45.92 1.03 Allowed Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.142 -0.974 . . . . 0.0 110.659 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.586 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.5 Cg_endo -73.87 -32.18 7.53 Favored 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.84 1.442 . . . . 0.0 110.271 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.623 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 24.0 p90 -71.09 -32.29 68.87 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 0.0 110.437 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.623 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 25.2 m120 -46.99 -52.87 13.69 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.236 -0.915 . . . . 0.0 109.96 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -59.02 -29.33 67.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.256 -0.903 . . . . 0.0 109.952 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.445 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 15.8 t90 -77.45 -37.56 51.27 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 110.333 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -91.24 -45.39 8.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.045 -1.034 . . . . 0.0 110.133 -179.729 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.525 HD11 ' HB3' ' A' ' 16' ' ' ASN . 99.5 mt -47.52 -50.71 22.87 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.848 -1.158 . . . . 0.0 109.216 179.44 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 80.3 tt0 -65.11 -31.35 72.52 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.331 -0.856 . . . . 0.0 109.105 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.7 tm? -55.42 -42.67 74.44 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.35 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.66 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.8 mp -82.74 -28.3 30.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.258 -0.901 . . . . 0.0 109.647 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 57.1 mm-40 -49.37 -24.34 1.88 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -83.24 -25.73 31.4 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 23' ' ' LEU . 71.1 mt -78.25 -37.94 43.99 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.1 ttpm? -58.35 -44.83 88.94 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 32' ' ' ARG . 70.9 m -58.22 -42.76 86.94 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.494 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.502 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 63.2 tt0 -62.06 -51.62 67.25 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.03 -46.11 82.61 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.443 HG21 ' HE2' ' A' ' 27' ' ' LYS . 51.6 t -64.33 -28.93 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.049 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 28' ' ' SER . 53.6 mtt180 -76.6 -32.69 58.24 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.59 0.709 . . . . 0.0 109.319 178.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.51 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 18.2 m80 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.149 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.442 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.214 -0.768 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.588 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 94.1 mt-10 52.08 44.59 2.15 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.453 -0.78 . . . . 0.0 110.507 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.588 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.3 Cg_endo -75.2 -27.57 9.58 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.606 1.319 . . . . 0.0 109.104 179.478 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.588 ' CE2' ' ND2' ' A' ' 16' ' ' ASN . 53.1 p90 -72.45 -29.8 64.01 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.631 -0.668 . . . . 0.0 109.966 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.749 ' O ' HD22 ' A' ' 20' ' ' LEU . 29.8 m120 -61.68 -19.25 62.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.405 -0.81 . . . . 0.0 110.502 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -75.56 -39.51 58.11 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.204 -0.935 . . . . 0.0 110.818 -179.332 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.555 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 64.0 p-90 -116.14 -35.96 4.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.97 -1.082 . . . . 0.0 111.031 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.493 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 70.9 m -49.57 -49.62 45.73 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.065 -1.022 . . . . 0.0 110.042 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.749 HD22 ' O ' ' A' ' 16' ' ' ASN . 4.2 mp -47.55 -54.38 11.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.106 -0.996 . . . . 0.0 109.287 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -70.75 -20.68 62.61 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.176 -0.952 . . . . 0.0 109.178 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.758 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.3 tm? -68.01 -33.86 75.42 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.435 -0.791 . . . . 0.0 109.476 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.973 HD23 HD12 ' A' ' 26' ' ' LEU . 94.3 mt -99.05 -19.15 17.39 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.326 -0.859 . . . . 0.0 109.655 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.6 mm-40 -49.11 -26.9 3.02 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 108.895 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -84.05 -25.85 29.52 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.973 HD12 HD23 ' A' ' 23' ' ' LEU . 66.8 mt -81.87 -29.52 32.44 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.466 -0.771 . . . . 0.0 109.039 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.431 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.2 ttpm? -63.32 -48.0 79.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.409 -0.807 . . . . 0.0 109.365 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.468 ' O ' ' N ' ' A' ' 32' ' ' ARG . 33.0 t -55.36 -37.79 67.97 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 91.9 mt-10 -65.2 -56.39 13.1 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.11 78.78 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.431 HG21 ' HE2' ' A' ' 27' ' ' LYS . 55.7 t -64.79 -27.46 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.585 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 10.2 mtp180 -79.12 -29.32 43.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.587 0.708 . . . . 0.0 109.199 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.585 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 16.7 m80 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.233 -179.357 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.456 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.718 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.581 ' HA ' ' CE2' ' A' ' 15' ' ' TYR . 73.8 mt-10 -123.14 51.67 3.9 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.241 -0.912 . . . . 0.0 109.995 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.525 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.6 Cg_endo -71.9 -31.71 12.29 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 124.164 1.612 . . . . 0.0 110.773 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.638 ' CE1' ' ND2' ' A' ' 16' ' ' ASN . 31.3 p90 -59.56 -24.11 63.45 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.3 -0.875 . . . . 0.0 110.948 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.638 ' ND2' ' CE1' ' A' ' 15' ' ' TYR . 13.4 m120 -39.97 -56.14 1.89 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.287 -0.883 . . . . 0.0 110.445 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -61.31 -26.96 68.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.302 -0.873 . . . . 0.0 110.729 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.471 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 12.3 t90 -76.23 -39.59 54.16 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.085 -1.01 . . . . 0.0 110.197 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -93.77 -45.73 7.54 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.102 -0.999 . . . . 0.0 110.066 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.52 ' CD1' ' HB3' ' A' ' 16' ' ' ASN . 61.0 mt -45.61 -49.6 14.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.967 -1.083 . . . . 0.0 109.243 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.513 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 42.8 tt0 -66.55 -23.66 66.25 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.0 109.129 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.944 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.8 tm? -67.51 -30.66 70.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.054 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.517 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.2 mp -95.58 -19.29 19.9 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.656 -0.653 . . . . 0.0 109.442 179.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.513 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 35.6 mt-10 -48.54 -29.1 3.87 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.349 -0.844 . . . . 0.0 108.804 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -85.19 -24.7 27.79 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.515 HD12 ' HG ' ' A' ' 23' ' ' LEU . 42.4 mt -75.84 -31.36 59.3 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.34 -0.85 . . . . 0.0 108.909 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.48 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.4 ttpm? -61.72 -48.73 79.41 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.455 -0.778 . . . . 0.0 109.08 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 65.8 m -53.39 -35.02 59.9 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 49.9 tt0 -65.71 -55.14 18.97 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.89 -45.74 85.95 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.48 HG21 ' HE2' ' A' ' 27' ' ' LYS . 41.9 t -64.71 -26.27 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.584 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 63.4 mtt180 -80.55 -30.37 37.09 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.708 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.584 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 14.3 m80 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 117.987 -1.006 . . . . 0.0 109.994 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.451 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.662 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.59 ' HA ' ' CE2' ' A' ' 15' ' ' TYR . 97.1 mt-10 -123.05 51.61 3.78 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.262 -0.899 . . . . 0.0 110.117 . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 46.1 Cg_endo -72.29 -28.11 15.63 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 O-C-N 123.941 1.495 . . . . 0.0 110.402 180.0 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.59 ' CE2' ' HA ' ' A' ' 13' ' ' GLU . 51.6 p90 -65.99 -31.42 72.31 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.256 -0.903 . . . . 0.0 110.518 -179.832 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.892 ' O ' HD22 ' A' ' 20' ' ' LEU . 44.9 m-20 -62.35 -16.94 57.48 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.254 -0.903 . . . . 0.0 110.306 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -76.3 -38.91 55.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.302 -0.874 . . . . 0.0 110.666 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.58 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 63.1 p-90 -117.11 -39.45 3.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.957 -1.089 . . . . 0.0 110.534 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.531 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 42.4 m -49.98 -44.24 50.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.085 -1.009 . . . . 0.0 110.063 -179.756 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.892 HD22 ' O ' ' A' ' 16' ' ' ASN . 3.8 mp -47.18 -54.03 11.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.87 -1.144 . . . . 0.0 109.237 179.359 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 37.4 tt0 -71.65 -14.61 62.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.898 . . . . 0.0 109.291 178.913 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.807 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.5 tm? -78.79 -30.63 45.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 109.237 179.143 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.988 HD23 HD12 ' A' ' 26' ' ' LEU . 89.2 mt -101.51 -17.35 16.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.552 -0.717 . . . . 0.0 109.51 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 12.5 mm-40 -48.41 -27.51 2.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.251 -0.906 . . . . 0.0 108.726 179.25 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -84.41 -27.16 27.8 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.872 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.988 HD12 HD23 ' A' ' 23' ' ' LEU . 16.9 mt -78.91 -28.01 43.87 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.479 -0.763 . . . . 0.0 109.08 178.994 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.657 ' O ' HG23 ' A' ' 31' ' ' VAL . 8.7 ttpp -61.46 -43.95 97.96 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.453 -0.779 . . . . 0.0 109.465 179.51 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.512 ' O ' ' N ' ' A' ' 32' ' ' ARG . 60.6 m -57.61 -41.57 81.51 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.678 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.491 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 76.9 tt0 -63.38 -51.91 63.88 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.569 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.33 81.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.913 -1.144 . . . . 0.0 107.913 178.176 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 27' ' ' LYS . 97.7 t -62.77 -30.31 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.043 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.577 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 60.1 mtt180 -74.91 -27.7 60.32 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.566 0.698 . . . . 0.0 109.4 179.114 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.577 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 19.1 m80 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.077 -179.352 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ACE . . . . . 0.455 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.714 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.564 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 50.4 mt-10 -122.56 48.59 1.89 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.305 -0.872 . . . . 0.0 110.238 . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.5 Cg_endo -71.95 -13.05 28.92 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.051 1.553 . . . . 0.0 110.697 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.539 ' O ' ' C ' ' A' ' 16' ' ' ASN . 29.0 p90 -88.34 -1.24 57.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.256 -0.902 . . . . 0.0 110.714 -179.539 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ASN . . . . . 0.539 ' C ' ' O ' ' A' ' 15' ' ' TYR . 12.5 m120 -22.16 -53.67 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 CA-C-O 121.129 0.49 . . . . 0.0 111.78 -179.284 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 15' ' ' TYR . 86.5 mt-10 -113.27 -10.29 13.34 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.118 -0.989 . . . . 0.0 110.429 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.502 ' HB3' ' HA ' ' A' ' 15' ' ' TYR . 62.8 t90 -61.1 -51.87 67.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.104 -0.997 . . . . 0.0 110.109 179.947 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -72.74 -37.85 67.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.314 -0.866 . . . . 0.0 109.999 -179.889 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.518 ' CD1' ' O ' ' A' ' 16' ' ' ASN . 41.9 mt -52.38 -40.34 61.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.37 -0.831 . . . . 0.0 109.674 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.468 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 75.3 tt0 -80.48 -17.63 51.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.319 179.209 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.877 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.0 tm? -68.63 -36.15 78.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.563 -0.711 . . . . 0.0 109.828 179.809 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.616 ' HA ' HD12 ' A' ' 26' ' ' LEU . 6.1 mp -87.86 -13.42 42.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.258 -0.901 . . . . 0.0 110.208 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.468 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 74.8 mt-10 -50.5 -27.64 6.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.086 -1.009 . . . . 0.0 109.135 179.915 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 14.3 pt-20 -82.55 -22.7 34.85 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.695 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.616 HD12 ' HA ' ' A' ' 23' ' ' LEU . 84.1 mt -79.33 -32.2 43.27 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.114 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.64 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.8 ttpm? -62.23 -41.79 98.73 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.48 -0.762 . . . . 0.0 109.705 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 32' ' ' ARG . 57.0 m -53.53 -39.85 65.01 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.371 -0.83 . . . . 0.0 108.907 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.468 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 8.5 tp10 -61.61 -51.85 66.81 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.581 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.26 80.85 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.194 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 27' ' ' LYS . 78.4 t -63.94 -26.97 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.208 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.538 ' HB3' ' CE1' ' A' ' 33' ' ' HIS . 40.2 mtt180 -78.44 -29.76 47.2 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.602 0.715 . . . . 0.0 109.389 178.876 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' HIS . . . . . 0.538 ' CE1' ' HB3' ' A' ' 32' ' ' ARG . 20.2 m80 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.22 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.255 0.55 . . . . 0.0 109.821 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.511 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 1.3 mp -51.03 -63.23 1.2 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.137 -0.977 . . . . 0.0 109.188 179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 74.8 tt0 -56.29 -26.63 52.64 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.241 -0.912 . . . . 0.0 109.27 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.516 ' HB2' ' HA ' ' A' ' 19' ' ' THR . 1.1 mm? -68.54 -46.1 70.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.447 -0.783 . . . . 0.0 109.755 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 1.096 HD13 HD12 ' A' ' 26' ' ' LEU . 2.2 mm? -70.11 -28.11 65.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.172 -0.955 . . . . 0.0 109.46 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 88.5 mt-10 -49.83 -24.25 2.32 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -81.84 -24.93 35.55 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.096 HD12 HD13 ' A' ' 23' ' ' LEU . 20.7 mt -78.28 -39.44 39.97 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.71 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.6 ttpm? -60.5 -45.38 93.99 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.58 -0.7 . . . . 0.0 109.21 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 46.5 m -58.11 -41.42 83.52 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 71.1 mm-40 -63.18 -52.93 60.41 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.15 -45.4 79.64 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 27' ' ' LYS . 98.7 t -64.84 -29.01 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 178.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 28' ' ' SER . 32.2 mtt-85 -76.35 -23.1 54.17 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.498 0.666 . . . . 0.0 109.533 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.4 ' NE2' ' HB3' ' A' ' 32' ' ' ARG . 42.9 m-70 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.203 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.348 0.594 . . . . 0.0 109.863 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.571 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 2.7 mp -61.37 -42.82 99.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.366 -0.834 . . . . 0.0 109.938 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.526 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 9.9 tp10 -66.33 -36.28 82.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.933 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -46.27 86.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.781 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.686 HD23 HD12 ' A' ' 26' ' ' LEU . 57.3 mt -67.24 -29.13 68.69 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.151 -0.968 . . . . 0.0 109.908 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.526 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 20.3 mm-40 -50.8 -23.82 3.03 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.036 -1.04 . . . . 0.0 108.233 179.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -76.0 -27.01 57.25 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.686 HD12 HD23 ' A' ' 23' ' ' LEU . 42.2 mt -83.82 -37.0 23.09 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.54 ' CD ' HG21 ' A' ' 31' ' ' VAL . 1.4 tmmt? -61.22 -47.21 87.15 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.521 -0.737 . . . . 0.0 109.543 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 49.3 m -56.77 -37.12 70.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.497 -0.752 . . . . 0.0 109.014 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.668 ' OE1' HD23 ' A' ' 26' ' ' LEU . 44.7 mt-10 -64.37 -55.56 20.27 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.45 ' O ' ' OXT' ' A' ' 33' ' ' HIS . . . -56.65 -46.24 81.16 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.54 HG21 ' CD ' ' A' ' 27' ' ' LYS . 73.6 t -64.3 -28.36 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.496 ' CG ' ' O ' ' A' ' 28' ' ' SER . 3.6 mtt180 -77.55 -28.58 51.92 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.583 0.706 . . . . 0.0 109.405 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.45 ' OXT' ' O ' ' A' ' 30' ' ' ALA . 33.3 m-70 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.056 -0.974 . . . . 0.0 110.189 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER . . . . . 0 N--CA 1.488 1.436 0 CA-C-O 121.248 0.547 . . . . 0.0 109.889 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.509 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 5.9 mp -46.39 -49.5 17.85 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.082 -1.011 . . . . 0.0 109.34 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.49 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 52.7 tt0 -62.09 -19.11 62.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.357 -0.839 . . . . 0.0 109.46 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.544 ' O ' ' CG ' ' A' ' 25' ' ' GLU . 12.5 tp -80.12 -38.08 32.31 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.307 -0.871 . . . . 0.0 109.39 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.957 HD23 HD12 ' A' ' 26' ' ' LEU . 71.6 mt -77.82 -24.23 48.77 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.0 178.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.49 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 36.9 mm-40 -52.9 -26.64 15.49 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 121.218 -0.926 . . . . 0.0 108.529 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.544 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -94.11 -12.27 28.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.428 -0.795 . . . . 0.0 109.238 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 HD23 ' A' ' 23' ' ' LEU . 78.7 mt -92.12 -28.36 17.15 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.268 -0.895 . . . . 0.0 109.009 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.645 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.8 ttpm? -65.51 -34.8 79.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.495 -0.753 . . . . 0.0 109.944 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.494 ' O ' ' N ' ' A' ' 32' ' ' ARG . 91.8 p -58.41 -40.14 81.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.235 -0.916 . . . . 0.0 109.262 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.519 ' OE2' ' CD2' ' A' ' 33' ' ' HIS . 51.6 tp10 -64.26 -54.65 30.0 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -45.99 78.36 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 27' ' ' LYS . 81.9 t -64.41 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 28' ' ' SER . 10.7 mtp180 -80.63 -28.33 36.99 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.559 0.695 . . . . 0.0 109.477 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.519 ' CD2' ' OE2' ' A' ' 29' ' ' GLU . 23.1 m-70 . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.207 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 17.3 m . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.215 0.531 . . . . 0.0 109.966 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 6.5 mp -51.5 -56.13 15.09 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 110.035 179.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 53.5 tt0 -51.86 -37.72 53.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.195 -0.941 . . . . 0.0 109.976 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.448 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 0.5 OUTLIER -64.58 -36.96 85.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.962 -1.086 . . . . 0.0 109.37 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.848 HD23 HD12 ' A' ' 26' ' ' LEU . 75.2 mt -75.23 -25.82 58.41 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.692 -0.803 . . . . 0.0 109.522 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 74.0 mt-10 -51.5 -23.14 3.7 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 8.9 pt-20 -82.26 -21.42 36.25 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.848 HD12 HD23 ' A' ' 23' ' ' LEU . 33.4 mt -89.73 -32.52 16.96 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.565 ' O ' HG23 ' A' ' 31' ' ' VAL . 2.4 ttpm? -64.46 -40.0 94.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.497 -0.752 . . . . 0.0 110.141 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.471 ' O ' ' N ' ' A' ' 32' ' ' ARG . 79.5 p -58.43 -40.49 82.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.203 -0.936 . . . . 0.0 109.288 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 22.7 tp10 -64.25 -53.75 44.21 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.36 -44.68 76.23 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 27' ' ' LYS . 74.4 t -65.8 -28.4 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.499 ' HB2' ' HA ' ' A' ' 29' ' ' GLU . 10.5 mtt-85 -78.38 -24.62 46.26 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.448 0.642 . . . . 0.0 109.591 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.26 -179.482 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.183 0.516 . . . . 0.0 110.142 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 82.0 mt -47.89 -40.64 22.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.897 -1.127 . . . . 0.0 109.451 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.481 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 83.8 tt0 -66.22 -33.77 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.346 -0.847 . . . . 0.0 109.943 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.576 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -60.17 -28.72 68.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -0.949 . . . . 0.0 109.021 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 1.035 HD23 HD12 ' A' ' 26' ' ' LEU . 83.2 mt -94.84 -23.43 17.48 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 48.3 mm-40 -49.39 -32.66 11.96 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 20.9 pt-20 -80.06 -21.72 43.11 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.699 -0.801 . . . . 0.0 109.15 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.035 HD12 HD23 ' A' ' 23' ' ' LEU . 18.9 mt -82.46 -33.73 28.35 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.369 -0.832 . . . . 0.0 109.369 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -61.29 -47.12 87.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.382 -0.824 . . . . 0.0 109.535 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 92.7 p -56.45 -36.84 69.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.595 -0.842 . . . . 0.0 108.832 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 33' ' ' HIS . 89.6 mt-10 -65.81 -55.32 17.76 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.43 -45.55 80.7 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -64.28 -27.56 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.522 ' CG ' ' O ' ' A' ' 28' ' ' SER . 9.9 mtp180 -81.77 -32.6 31.36 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.475 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.495 ' N ' ' O ' ' A' ' 29' ' ' GLU . 20.1 m-70 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.023 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.5 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 121.195 0.521 . . . . 0.0 109.805 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.546 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 2.0 mp -55.07 -49.78 70.78 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.996 -1.065 . . . . 0.0 108.587 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.491 ' HA ' ' HB2' ' A' ' 24' ' ' GLU . 39.6 tt0 -68.22 -27.0 65.99 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.497 -0.752 . . . . 0.0 109.277 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.796 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.1 tm? -57.27 -40.09 76.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.382 -0.824 . . . . 0.0 109.197 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.773 ' CD2' HD12 ' A' ' 26' ' ' LEU . 89.4 mt -92.23 -21.2 20.47 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.511 -0.743 . . . . 0.0 109.888 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 26.1 mm-40 -50.64 -22.38 2.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.246 -0.908 . . . . 0.0 108.906 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.414 ' OE2' ' O ' ' A' ' 22' ' ' LEU . 18.4 pt-20 -82.93 -26.93 30.95 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.773 HD12 ' CD2' ' A' ' 23' ' ' LEU . 54.8 mt -80.9 -34.06 33.8 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.463 -0.773 . . . . 0.0 109.105 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.502 ' O ' HG23 ' A' ' 31' ' ' VAL . 9.5 ttpp -59.26 -46.55 88.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 109.441 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.3 m -57.7 -42.05 82.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.737 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 92.9 mt-10 -62.05 -52.72 62.8 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.31 83.38 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 27' ' ' LYS . 69.2 t -62.24 -29.98 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 28' ' ' SER . 57.8 mtt180 -75.46 -28.85 59.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.559 0.695 . . . . 0.0 109.506 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.989 -179.457 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.594 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 43.3 m . . . . . 0 N--CA 1.495 1.818 0 CA-C-O 121.28 0.562 . . . . 0.0 110.049 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.485 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 7.0 mp -47.41 -52.58 16.43 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.016 -1.053 . . . . 0.0 108.466 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 84.2 tt0 -68.91 -28.02 66.29 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.753 ' O ' HD13 ' A' ' 22' ' ' LEU . 3.4 tm? -65.36 -33.53 76.17 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 26' ' ' LEU . 87.3 mt -94.16 -18.22 21.96 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.535 -0.728 . . . . 0.0 109.769 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 5.7 mt-10 -51.75 -21.44 2.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.064 -1.022 . . . . 0.0 109.127 179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -80.59 -23.57 39.76 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.487 ' HA ' HD23 ' A' ' 26' ' ' LEU . 18.7 mt -91.8 -36.77 13.35 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.517 -0.739 . . . . 0.0 109.572 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.551 ' HG3' ' N ' ' A' ' 28' ' ' SER . 13.6 pttp -60.21 -38.43 83.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 0.0 109.799 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.551 ' N ' ' HG3' ' A' ' 27' ' ' LYS . 30.0 m -67.06 -33.5 75.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.291 -0.88 . . . . 0.0 109.488 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.442 ' O ' ' N ' ' A' ' 33' ' ' HIS . 95.2 mt-10 -63.99 -55.85 19.34 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.53 76.59 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.178 -0.951 . . . . 0.0 108.555 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.0 t -68.04 -28.24 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.468 ' N ' ' O ' ' A' ' 28' ' ' SER . 5.1 mtp180 -81.11 -25.28 37.08 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.546 0.688 . . . . 0.0 109.477 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.442 ' N ' ' O ' ' A' ' 29' ' ' GLU . 29.5 m-70 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.184 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 3.1 m . . . . . 0 N--CA 1.491 1.579 0 CA-C-O 121.32 0.581 . . . . 0.0 110.014 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.597 ' N ' HD12 ' A' ' 20' ' ' LEU . 8.4 mp -60.97 -46.21 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.261 -0.899 . . . . 0.0 109.602 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 27.7 tt0 -62.33 -35.34 78.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.852 . . . . 0.0 109.972 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -39.9 95.14 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.176 -0.952 . . . . 0.0 109.606 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 1.067 HD23 HD12 ' A' ' 26' ' ' LEU . 91.9 mt -71.52 -28.3 63.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.379 -0.826 . . . . 0.0 109.937 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 95.1 mt-10 -51.09 -22.95 2.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 1.067 HD12 HD23 ' A' ' 23' ' ' LEU . 62.8 mt -82.23 -40.96 20.89 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.6 ttpm? -58.52 -44.77 89.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.515 -0.74 . . . . 0.0 109.22 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 89.9 p -58.94 -37.35 76.52 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.519 ' OE1' HD23 ' A' ' 26' ' ' LEU . 94.3 mt-10 -63.78 -53.04 57.09 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.11 -47.4 83.39 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 27' ' ' LYS . 96.9 t -63.12 -28.41 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 28' ' ' SER . 12.7 mtt85 -76.77 -34.48 58.01 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.598 0.713 . . . . 0.0 109.435 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 117.974 -1.013 . . . . 0.0 109.899 -179.38 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.573 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 60.4 m . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 121.136 0.494 . . . . 0.0 109.885 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.47 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 5.3 mp -51.1 -52.97 38.48 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.988 -1.07 . . . . 0.0 109.117 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -73.78 -15.76 61.18 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.0 109.22 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.725 HD13 ' C ' ' A' ' 22' ' ' LEU . 3.4 tm? -73.69 -33.69 64.53 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.429 -0.794 . . . . 0.0 109.47 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.947 HD23 HD12 ' A' ' 26' ' ' LEU . 34.4 mt -98.22 -19.41 17.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.49 -0.757 . . . . 0.0 109.661 179.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 11.3 mm-40 -49.14 -27.07 3.2 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.326 -0.859 . . . . 0.0 108.843 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -83.35 -22.25 32.9 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.57 -0.706 . . . . 0.0 109.319 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.947 HD12 HD23 ' A' ' 23' ' ' LEU . 27.8 mt -85.83 -27.98 24.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.38 -0.825 . . . . 0.0 109.277 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.505 ' O ' HG23 ' A' ' 31' ' ' VAL . 19.4 ttpp -61.35 -47.43 85.89 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.465 -0.772 . . . . 0.0 109.35 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CD ' ' A' ' 32' ' ' ARG . 87.5 p -56.51 -38.75 72.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.711 ' OE1' HD23 ' A' ' 26' ' ' LEU . 96.3 mt-10 -64.9 -56.47 13.12 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.2 -45.51 79.83 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 27' ' ' LYS . 78.4 t -65.22 -28.27 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.522 ' CD ' ' O ' ' A' ' 28' ' ' SER . 3.7 mtp180 -79.41 -32.88 42.98 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.619 0.723 . . . . 0.0 109.384 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.438 ' N ' ' O ' ' A' ' 29' ' ' GLU . 26.4 m-70 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.156 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 58.5 m . . . . . 0 N--CA 1.488 1.43 0 CA-C-O 121.547 0.689 . . . . 0.0 109.579 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 9.2 tp -45.28 -51.78 10.48 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.511 -0.743 . . . . 0.0 109.927 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.494 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 72.1 tt0 -67.04 -30.78 70.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.154 -0.967 . . . . 0.0 110.231 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.51 -38.3 74.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.95 -1.094 . . . . 0.0 109.641 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.675 ' CD2' HD12 ' A' ' 26' ' ' LEU . 55.0 mt -64.91 -24.23 67.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.261 -0.9 . . . . 0.0 109.844 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 95.4 mt-10 -51.42 -22.58 3.11 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.433 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -77.57 -26.16 50.62 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.675 HD12 ' CD2' ' A' ' 23' ' ' LEU . 19.6 mt -83.72 -36.99 23.26 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.412 0.625 . . . . 0.0 109.399 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.564 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.7 ttpm? -60.03 -45.69 91.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.397 -0.814 . . . . 0.0 109.44 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.459 ' O ' ' N ' ' A' ' 32' ' ' ARG . 22.6 t -56.18 -38.26 70.7 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 78.2 mt-10 -64.74 -55.1 21.96 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -44.07 77.0 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.564 HG21 ' HE2' ' A' ' 27' ' ' LYS . 41.8 t -66.15 -27.28 40.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.474 ' HB2' ' HA ' ' A' ' 29' ' ' GLU . 36.0 mtt-85 -78.66 -34.11 46.62 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.538 0.685 . . . . 0.0 109.471 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' A' ' 29' ' ' GLU . 35.5 m-70 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.203 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.489 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 1.8 m . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.279 0.561 . . . . 0.0 109.856 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 36.1 mt -48.11 -32.9 7.45 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.14 -0.975 . . . . 0.0 109.698 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.551 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 88.0 tt0 -75.71 -26.4 57.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.319 -0.863 . . . . 0.0 109.733 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.559 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -66.53 -41.47 88.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.215 -0.928 . . . . 0.0 109.325 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.901 HD23 HD12 ' A' ' 26' ' ' LEU . 88.7 mt -68.92 -22.89 64.13 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.346 -0.846 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.551 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 65.6 mm-40 -50.25 -30.71 12.33 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.196 -1.001 . . . . 0.0 108.415 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -78.34 -24.32 46.57 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.901 HD12 HD23 ' A' ' 23' ' ' LEU . 40.8 mt -87.22 -27.72 22.8 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.603 -0.685 . . . . 0.0 109.26 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.708 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.6 ttpm? -63.91 -48.26 77.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.502 -0.749 . . . . 0.0 109.39 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 23.0 t -55.91 -38.38 70.16 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.335 -0.853 . . . . 0.0 108.878 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.416 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 71.8 mm-40 -64.39 -55.77 18.79 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.68 -44.16 81.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.708 HG21 ' HE2' ' A' ' 27' ' ' LYS . 77.2 t -66.66 -25.47 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 28' ' ' SER . 65.8 mtt180 -81.03 -22.57 39.26 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-O 121.497 0.665 . . . . 0.0 109.456 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 42.5 m-70 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.148 -179.359 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.038 0.447 . . . . 0.0 110.343 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 88.2 mt -44.28 -45.03 8.43 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.104 -0.997 . . . . 0.0 109.171 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 88.2 tt0 -74.5 -27.23 60.46 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.364 -0.835 . . . . 0.0 108.792 178.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.4 tm? -65.48 -37.47 86.92 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.592 -0.692 . . . . 0.0 109.515 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.876 HD23 HD12 ' A' ' 26' ' ' LEU . 92.2 mt -92.31 -19.3 22.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.406 -0.808 . . . . 0.0 109.987 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 7.9 mm-40 -49.51 -23.76 1.75 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 108.849 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -78.57 -29.9 46.5 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.876 HD12 HD23 ' A' ' 23' ' ' LEU . 63.8 mt -79.55 -33.96 41.43 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 121.577 -0.702 . . . . 0.0 109.203 179.023 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.489 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.3 ttpm? -62.8 -48.14 80.4 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.408 -0.808 . . . . 0.0 109.366 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.467 ' O ' ' N ' ' A' ' 32' ' ' ARG . 58.2 m -55.1 -36.35 65.58 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.635 -0.826 . . . . 0.0 108.906 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.494 ' OE1' HD23 ' A' ' 26' ' ' LEU . 95.5 mt-10 -65.01 -55.53 18.41 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.45 -46.56 80.28 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.489 HG21 ' HE2' ' A' ' 27' ' ' LYS . 71.0 t -63.2 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 178.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.8 mtt-85 -77.83 -30.7 51.24 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.646 0.736 . . . . 0.0 109.544 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.416 ' N ' ' O ' ' A' ' 29' ' ' GLU . 31.7 m-70 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.138 -179.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.491 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 CA-C-O 121.133 0.492 . . . . 0.0 110.481 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.592 HD22 ' N ' ' A' ' 20' ' ' LEU . 4.1 mm? -64.11 -38.9 92.74 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.899 -1.126 . . . . 0.0 109.139 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.411 ' HA ' ' HB2' ' A' ' 24' ' ' GLU . 77.5 tt0 -64.98 -31.26 72.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.493 -0.755 . . . . 0.0 109.613 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.536 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -59.79 -41.67 91.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.285 -0.884 . . . . 0.0 109.431 179.358 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.601 ' N ' HD12 ' A' ' 23' ' ' LEU . 10.4 mp -83.67 -27.11 29.3 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.316 -0.865 . . . . 0.0 109.241 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.3 mm-40 -50.19 -27.46 5.93 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.522 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -89.44 -14.61 35.02 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.398 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 23' ' ' LEU . 72.1 mt -83.59 -38.7 21.29 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.271 -0.893 . . . . 0.0 109.17 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.609 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.9 ttpm? -60.72 -48.07 83.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.941 . . . . 0.0 109.304 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 32' ' ' ARG . 99.2 p -54.7 -36.2 64.44 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 70.2 mm-40 -64.85 -54.96 22.82 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 178.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.88 -45.28 78.61 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.609 HG21 ' HE2' ' A' ' 27' ' ' LYS . 99.3 t -64.78 -30.63 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.0 mtt180 -76.07 -27.25 57.16 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.53 0.681 . . . . 0.0 109.545 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.427 ' N ' ' O ' ' A' ' 29' ' ' GLU . 34.0 m-70 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.996 -1.002 . . . . 0.0 109.992 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.362 0.601 . . . . 0.0 110.055 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.451 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 74.6 mt -60.7 -42.07 96.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.328 -0.858 . . . . 0.0 110.206 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.508 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 50.8 tt0 -69.43 -37.43 77.41 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.156 -0.965 . . . . 0.0 110.008 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.53 -42.75 97.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.024 -1.048 . . . . 0.0 109.638 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.914 HD23 HD12 ' A' ' 26' ' ' LEU . 80.0 mt -64.64 -25.13 67.82 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.278 -0.889 . . . . 0.0 109.949 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.508 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 82.0 mt-10 -49.6 -25.78 3.07 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.076 -1.05 . . . . 0.0 108.368 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -76.36 -26.71 55.96 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.914 HD12 HD23 ' A' ' 23' ' ' LEU . 25.2 mt -81.95 -37.07 27.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.576 -0.702 . . . . 0.0 109.204 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.646 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.4 ttpm? -59.86 -46.31 89.69 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.423 -0.798 . . . . 0.0 109.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.2 m -56.55 -38.12 71.48 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.445 ' O ' ' N ' ' A' ' 33' ' ' HIS . 61.6 mm-40 -65.41 -56.6 11.59 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.11 -44.86 79.51 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.646 HG21 ' HE2' ' A' ' 27' ' ' LYS . 53.9 t -64.67 -30.49 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 28' ' ' SER . 13.5 mtp180 -76.22 -33.23 59.23 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-O 121.656 0.741 . . . . 0.0 109.334 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 29' ' ' GLU . 23.7 m-70 . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.226 -179.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.523 0 CA-C-O 121.208 0.528 . . . . 0.0 109.933 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.471 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 93.0 mt -46.4 -51.19 15.49 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.241 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 67.8 tt0 -59.71 -28.33 67.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.474 -0.766 . . . . 0.0 109.617 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.531 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 16.6 tp -65.39 -37.71 87.79 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.198 -0.939 . . . . 0.0 109.389 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.636 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.0 mp -80.93 -25.84 37.15 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.255 -0.978 . . . . 0.0 108.84 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 54.0 mm-40 -50.9 -29.09 11.09 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -87.99 -21.01 25.07 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.632 HD12 ' HA ' ' A' ' 23' ' ' LEU . 77.4 mt -77.05 -35.66 56.58 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.493 ' O ' HG23 ' A' ' 31' ' ' VAL . 2.0 ttpm? -59.59 -45.62 91.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 68.7 m -57.84 -42.2 83.91 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 91.1 mt-10 -63.02 -53.93 46.11 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 178.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.0 -45.54 75.08 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 27' ' ' LYS . 55.7 t -64.69 -31.98 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.7 mtt-85 -72.55 -27.36 62.16 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.497 0.665 . . . . 0.0 109.411 178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 39.7 m-70 . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.166 -179.48 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.586 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 77.0 m . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.249 0.547 . . . . 0.0 109.842 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.527 ' O ' ' CG ' ' A' ' 24' ' ' GLU . 3.3 mp -52.14 -50.36 61.9 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.939 . . . . 0.0 109.065 179.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 60.4 tt0 -74.24 -17.19 60.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.236 -0.915 . . . . 0.0 108.854 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.734 ' O ' HD13 ' A' ' 22' ' ' LEU . 3.4 tm? -75.78 -33.28 60.17 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.562 0.696 . . . . 0.0 109.315 179.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.545 HD23 HG22 ' A' ' 19' ' ' THR . 3.3 pp -104.53 -12.12 16.64 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.529 -0.732 . . . . 0.0 109.902 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' A' ' 20' ' ' LEU . 3.7 mm-40 -50.58 -30.52 13.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.182 -0.948 . . . . 0.0 108.831 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -84.87 -23.0 29.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' A' ' 23' ' ' LEU . 76.5 mt -80.97 -27.39 35.99 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.453 0.644 . . . . 0.0 109.446 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 ttpp -65.35 -48.99 71.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 109.629 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 32' ' ' ARG . 61.1 m -54.58 -39.62 67.99 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 33' ' ' HIS . 94.1 mt-10 -64.22 -54.51 32.32 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.64 -45.64 81.48 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 178.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.19 -28.7 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.489 ' N ' ' O ' ' A' ' 28' ' ' SER . 55.6 mtt180 -79.19 -30.71 43.54 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.679 -0.638 . . . . 0.0 109.448 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.462 ' N ' ' O ' ' A' ' 29' ' ' GLU . 23.9 m-70 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 118.146 -0.931 . . . . 0.0 110.231 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.508 ' O ' ' N ' ' A' ' 22' ' ' LEU . 1.8 m . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 120.988 0.423 . . . . 0.0 110.203 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.485 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 6.1 mp -44.27 -52.29 7.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -61.65 -30.31 70.64 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.809 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.1 tm? -64.41 -40.77 96.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.505 -0.747 . . . . 0.0 109.558 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.609 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.7 mp -83.34 -26.72 30.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.273 -0.892 . . . . 0.0 109.78 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 73.2 mt-10 -50.13 -23.21 2.01 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.159 -0.963 . . . . 0.0 108.465 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -85.6 -23.02 27.75 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' LEU . 57.3 mt -82.4 -34.32 28.36 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.401 -0.812 . . . . 0.0 109.02 179.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 31' ' ' VAL . 11.2 ttpp -58.83 -45.69 89.41 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.237 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.488 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.7 m -58.0 -43.25 86.55 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.476 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 76.1 mm-40 -62.06 -51.83 66.4 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -48.47 78.35 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 27' ' ' LYS . 53.2 t -62.38 -26.39 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 28' ' ' SER . 8.8 mtt-85 -80.35 -26.18 38.82 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.495 0.664 . . . . 0.0 109.271 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.426 ' N ' ' O ' ' A' ' 29' ' ' GLU . 30.6 m-70 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.101 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.49 1.543 0 CA-C-O 121.111 0.482 . . . . 0.0 110.133 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 99.5 mt -47.52 -50.71 22.87 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.848 -1.158 . . . . 0.0 109.216 179.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 80.3 tt0 -65.11 -31.35 72.52 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.331 -0.856 . . . . 0.0 109.105 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.747 ' O ' HD13 ' A' ' 22' ' ' LEU . 2.7 tm? -55.42 -42.67 74.44 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.35 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.66 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.8 mp -82.74 -28.3 30.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.258 -0.901 . . . . 0.0 109.647 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 57.1 mm-40 -49.37 -24.34 1.88 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -83.24 -25.73 31.4 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 23' ' ' LEU . 71.1 mt -78.25 -37.94 43.99 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.1 ttpm? -58.35 -44.83 88.94 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 32' ' ' ARG . 70.9 m -58.22 -42.76 86.94 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.502 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 63.2 tt0 -62.06 -51.62 67.25 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.03 -46.11 82.61 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.443 HG21 ' HE2' ' A' ' 27' ' ' LYS . 51.6 t -64.33 -28.93 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 28' ' ' SER . 53.6 mtt180 -76.6 -32.69 58.24 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.59 0.709 . . . . 0.0 109.319 178.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' A' ' 29' ' ' GLU . 31.9 m-70 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.149 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.485 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 70.9 m . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 121.253 0.549 . . . . 0.0 110.042 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 4.2 mp -47.55 -54.38 11.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.106 -0.996 . . . . 0.0 109.287 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -70.75 -20.68 62.61 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.176 -0.952 . . . . 0.0 109.178 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.758 ' O ' HD13 ' A' ' 22' ' ' LEU . 3.3 tm? -68.01 -33.86 75.42 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.435 -0.791 . . . . 0.0 109.476 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.973 HD23 HD12 ' A' ' 26' ' ' LEU . 94.3 mt -99.05 -19.15 17.39 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.326 -0.859 . . . . 0.0 109.655 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.6 mm-40 -49.11 -26.9 3.02 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 108.895 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -84.05 -25.85 29.52 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.973 HD12 HD23 ' A' ' 23' ' ' LEU . 66.8 mt -81.87 -29.52 32.44 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.466 -0.771 . . . . 0.0 109.039 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.431 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.2 ttpm? -63.32 -48.0 79.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.409 -0.807 . . . . 0.0 109.365 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.468 ' O ' ' N ' ' A' ' 32' ' ' ARG . 33.0 t -55.36 -37.79 67.97 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 91.9 mt-10 -65.2 -56.39 13.1 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.11 78.78 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.431 HG21 ' HE2' ' A' ' 27' ' ' LYS . 55.7 t -64.79 -27.46 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.468 ' N ' ' O ' ' A' ' 28' ' ' SER . 10.2 mtp180 -79.12 -29.32 43.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.587 0.708 . . . . 0.0 109.199 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.416 ' N ' ' O ' ' A' ' 29' ' ' GLU . 28.2 m-70 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.233 -179.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.184 0.516 . . . . 0.0 110.066 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.452 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 61.0 mt -45.61 -49.6 14.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.967 -1.083 . . . . 0.0 109.243 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.513 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 42.8 tt0 -66.55 -23.66 66.25 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.0 109.129 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.944 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.8 tm? -67.51 -30.66 70.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.517 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.2 mp -95.58 -19.29 19.9 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.656 -0.653 . . . . 0.0 109.442 179.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.513 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 35.6 mt-10 -48.54 -29.1 3.87 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.349 -0.844 . . . . 0.0 108.804 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -85.19 -24.7 27.79 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.515 HD12 ' HG ' ' A' ' 23' ' ' LEU . 42.4 mt -75.84 -31.36 59.3 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.34 -0.85 . . . . 0.0 108.909 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.48 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.4 ttpm? -61.72 -48.73 79.41 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.455 -0.778 . . . . 0.0 109.08 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 65.8 m -53.39 -35.02 59.9 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 49.9 tt0 -65.71 -55.14 18.97 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.89 -45.74 85.95 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.48 HG21 ' HE2' ' A' ' 27' ' ' LYS . 41.9 t -64.71 -26.27 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.511 ' CG ' ' O ' ' A' ' 28' ' ' SER . 63.4 mtt180 -80.55 -30.37 37.09 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . 0.442 ' N ' ' O ' ' A' ' 29' ' ' GLU . 23.7 m-70 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 117.987 -1.006 . . . . 0.0 109.994 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.531 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 42.4 m . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.186 0.517 . . . . 0.0 110.063 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.482 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 3.8 mp -47.18 -54.03 11.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.87 -1.144 . . . . 0.0 109.237 179.359 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 37.4 tt0 -71.65 -14.61 62.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.898 . . . . 0.0 109.291 178.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.807 ' O ' HD13 ' A' ' 22' ' ' LEU . 3.5 tm? -78.79 -30.63 45.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 109.237 179.143 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.988 HD23 HD12 ' A' ' 26' ' ' LEU . 89.2 mt -101.51 -17.35 16.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.552 -0.717 . . . . 0.0 109.51 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 12.5 mm-40 -48.41 -27.51 2.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.251 -0.906 . . . . 0.0 108.726 179.25 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -84.41 -27.16 27.8 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.872 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.988 HD12 HD23 ' A' ' 23' ' ' LEU . 16.9 mt -78.91 -28.01 43.87 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.479 -0.763 . . . . 0.0 109.08 178.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.657 ' O ' HG23 ' A' ' 31' ' ' VAL . 8.7 ttpp -61.46 -43.95 97.96 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.453 -0.779 . . . . 0.0 109.465 179.51 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.512 ' O ' ' N ' ' A' ' 32' ' ' ARG . 60.6 m -57.61 -41.57 81.51 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.678 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.491 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 76.9 tt0 -63.38 -51.91 63.88 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.569 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.33 81.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.913 -1.144 . . . . 0.0 107.913 178.176 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 27' ' ' LYS . 97.7 t -62.77 -30.31 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.043 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' A' ' 28' ' ' SER . 60.1 mtt180 -74.91 -27.7 60.32 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.566 0.698 . . . . 0.0 109.4 179.114 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.077 -179.352 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.346 0.593 . . . . 0.0 109.999 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.446 ' O ' ' HG3' ' A' ' 24' ' ' GLU . 41.9 mt -52.38 -40.34 61.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.37 -0.831 . . . . 0.0 109.674 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.468 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 75.3 tt0 -80.48 -17.63 51.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.319 179.209 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.877 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.0 tm? -68.63 -36.15 78.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.563 -0.711 . . . . 0.0 109.828 179.809 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.616 ' HA ' HD12 ' A' ' 26' ' ' LEU . 6.1 mp -87.86 -13.42 42.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.258 -0.901 . . . . 0.0 110.208 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.468 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 74.8 mt-10 -50.5 -27.64 6.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.086 -1.009 . . . . 0.0 109.135 179.915 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 14.3 pt-20 -82.55 -22.7 34.85 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.695 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.616 HD12 ' HA ' ' A' ' 23' ' ' LEU . 84.1 mt -79.33 -32.2 43.27 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.114 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.64 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.8 ttpm? -62.23 -41.79 98.73 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.48 -0.762 . . . . 0.0 109.705 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 32' ' ' ARG . 57.0 m -53.53 -39.85 65.01 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.371 -0.83 . . . . 0.0 108.907 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.468 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 8.5 tp10 -61.61 -51.85 66.81 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.581 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.26 80.85 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.194 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 27' ' ' LYS . 78.4 t -63.94 -26.97 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.208 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.2 mtt180 -78.44 -29.76 47.2 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.602 0.715 . . . . 0.0 109.389 178.876 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.8 m-70 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.22 -179.338 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.47 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.731 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.562 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.1 mt-10 -122.22 48.8 1.86 Allowed Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.212 -0.93 . . . . 0.0 110.293 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.562 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.4 Cg_endo -72.68 -34.99 6.39 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 O-C-N 124.004 1.528 . . . . 0.0 110.093 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.647 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 31.5 p90 -64.49 -33.31 75.6 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.393 -0.817 . . . . 0.0 110.241 179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.666 ' O ' HD22 ' A' ' 20' ' ' LEU . 10.8 t-20 -45.61 -49.18 14.44 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.338 -0.851 . . . . 0.0 109.994 -179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 94.3 mt-10 -69.83 -25.47 63.77 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.155 -0.966 . . . . 0.0 110.16 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.884 ' O ' HD23 ' A' ' 22' ' ' LEU . 40.9 t90 -76.61 -44.45 34.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.15 -0.969 . . . . 0.0 110.024 179.656 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.516 ' HA ' ' HB2' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -73.67 -47.02 42.94 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.25 -0.906 . . . . 0.0 109.821 179.919 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.666 HD22 ' O ' ' A' ' 16' ' ' ASN . 1.3 mp -51.03 -63.23 1.2 Allowed 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.137 -0.977 . . . . 0.0 109.188 179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.447 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 74.8 tt0 -56.29 -26.63 52.64 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.241 -0.912 . . . . 0.0 109.27 178.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.884 HD23 ' O ' ' A' ' 18' ' ' TRP . 1.1 mm? -68.54 -46.1 70.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.447 -0.783 . . . . 0.0 109.755 179.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 1.096 HD13 HD12 ' A' ' 26' ' ' LEU . 2.2 mm? -70.11 -28.11 65.12 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.172 -0.955 . . . . 0.0 109.46 179.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.488 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 88.5 mt-10 -49.83 -24.25 2.32 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 108.417 -0.957 . . . . 0.0 108.417 179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 86.4 mt-10 -81.84 -24.93 35.55 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.852 -0.795 . . . . 0.0 108.852 178.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.096 HD12 HD13 ' A' ' 23' ' ' LEU . 20.7 mt -78.28 -39.44 39.97 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.71 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.6 ttpm? -60.5 -45.38 93.99 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.58 -0.7 . . . . 0.0 109.21 178.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 46.5 m -58.11 -41.42 83.52 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 179.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 71.1 mm-40 -63.18 -52.93 60.41 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 178.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.15 -45.4 79.64 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 178.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.71 HG23 ' O ' ' A' ' 27' ' ' LYS . 98.7 t -64.84 -29.01 46.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.329 0 N-CA-C 108.12 -1.066 . . . . 0.0 108.12 178.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 28' ' ' SER . 32.2 mtt-85 -76.35 -23.1 54.17 Favored 'General case' 0 N--CA 1.487 1.396 0 CA-C-O 121.498 0.666 . . . . 0.0 109.533 179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.4 ' NE2' ' HB3' ' A' ' 32' ' ' ARG . 42.9 m-70 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 117.956 -1.021 . . . . 0.0 110.203 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.472 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.679 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.571 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 96.5 mt-10 -122.97 47.76 1.71 Allowed Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.26 -0.9 . . . . 0.0 110.411 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.571 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 49.6 Cg_endo -74.57 -31.26 7.14 Favored 'Trans proline' 0 C--N 1.308 -1.581 0 O-C-N 123.949 1.5 . . . . 0.0 110.172 179.683 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.572 ' CE1' ' OD1' ' A' ' 16' ' ' ASN . 43.8 p90 -67.01 -26.6 66.87 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.436 -0.79 . . . . 0.0 110.542 -179.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.749 ' O ' HD22 ' A' ' 20' ' ' LEU . 30.8 m-20 -40.13 -49.6 2.61 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.411 -0.806 . . . . 0.0 110.588 -179.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 14' ' ' PRO . 10.5 pt-20 -74.34 -30.44 62.02 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.109 -0.994 . . . . 0.0 110.408 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 71.7 t90 -64.39 -53.89 41.43 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.13 -0.981 . . . . 0.0 110.03 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.85 -45.27 75.06 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.34 -0.85 . . . . 0.0 109.863 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.749 HD22 ' O ' ' A' ' 16' ' ' ASN . 2.7 mp -61.37 -42.82 99.32 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.366 -0.834 . . . . 0.0 109.938 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.526 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 9.9 tp10 -66.33 -36.28 82.5 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.248 -0.907 . . . . 0.0 109.933 179.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -63.57 -46.27 86.66 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.196 -0.94 . . . . 0.0 109.781 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.686 HD23 HD12 ' A' ' 26' ' ' LEU . 57.3 mt -67.24 -29.13 68.69 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.151 -0.968 . . . . 0.0 109.908 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.526 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 20.3 mm-40 -50.8 -23.82 3.03 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.036 -1.04 . . . . 0.0 108.233 179.278 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.8 mt-10 -76.0 -27.01 57.25 Favored 'General case' 0 N--CA 1.487 1.391 0 N-CA-C 108.411 -0.959 . . . . 0.0 108.411 178.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.686 HD12 HD23 ' A' ' 23' ' ' LEU . 42.2 mt -83.82 -37.0 23.09 Favored 'General case' 0 N--CA 1.485 1.319 0 N-CA-C 108.597 -0.89 . . . . 0.0 108.597 178.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.54 ' CD ' HG21 ' A' ' 31' ' ' VAL . 1.4 tmmt? -61.22 -47.21 87.15 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.521 -0.737 . . . . 0.0 109.543 179.122 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 49.3 m -56.77 -37.12 70.64 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.497 -0.752 . . . . 0.0 109.014 179.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.668 ' OE1' HD23 ' A' ' 26' ' ' LEU . 44.7 mt-10 -64.37 -55.56 20.27 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 178.473 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.45 ' O ' ' OXT' ' A' ' 33' ' ' HIS . . . -56.65 -46.24 81.16 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 178.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.54 HG21 ' CD ' ' A' ' 27' ' ' LYS . 73.6 t -64.3 -28.36 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.345 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.496 ' CG ' ' O ' ' A' ' 28' ' ' SER . 3.6 mtt180 -77.55 -28.58 51.92 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-O 121.583 0.706 . . . . 0.0 109.405 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.45 ' OXT' ' O ' ' A' ' 30' ' ' ALA . 33.3 m-70 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 118.056 -0.974 . . . . 0.0 110.189 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.443 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.73 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.519 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.6 mt-10 -126.18 52.85 7.95 Favored Pre-proline 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.909 . . . . 0.0 110.048 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.9 Cg_endo -74.66 -32.42 5.96 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 124.217 1.64 . . . . 0.0 110.03 179.771 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.565 ' CG ' ' N ' ' A' ' 16' ' ' ASN . 44.0 p90 -68.1 -43.33 78.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.645 -0.659 . . . . 0.0 110.558 -179.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.565 ' N ' ' CG ' ' A' ' 15' ' ' TYR . 20.4 m120 44.86 82.4 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.215 -0.928 . . . . 0.0 110.754 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.479 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 79.4 mm-40 60.79 10.03 2.5 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.587 -0.696 . . . . 0.0 110.772 179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.523 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 9.1 t90 -81.65 -41.2 21.76 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.107 -0.995 . . . . 0.0 109.374 179.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.533 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.9 OUTLIER -55.71 -50.42 70.38 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.353 -0.842 . . . . 0.0 109.889 179.749 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.509 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 5.9 mp -46.39 -49.5 17.85 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.082 -1.011 . . . . 0.0 109.34 179.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.49 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 52.7 tt0 -62.09 -19.11 62.62 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.357 -0.839 . . . . 0.0 109.46 179.274 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.544 ' O ' ' CG ' ' A' ' 25' ' ' GLU . 12.5 tp -80.12 -38.08 32.31 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.307 -0.871 . . . . 0.0 109.39 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.957 HD23 HD12 ' A' ' 26' ' ' LEU . 71.6 mt -77.82 -24.23 48.77 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 119.175 -1.01 . . . . 0.0 109.0 178.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.49 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 36.9 mm-40 -52.9 -26.64 15.49 Favored 'General case' 0 N--CA 1.485 1.308 0 O-C-N 121.218 -0.926 . . . . 0.0 108.529 178.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.544 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -94.11 -12.27 28.8 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.428 -0.795 . . . . 0.0 109.238 178.677 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.957 HD12 HD23 ' A' ' 23' ' ' LEU . 78.7 mt -92.12 -28.36 17.15 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.268 -0.895 . . . . 0.0 109.009 178.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.645 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.8 ttpm? -65.51 -34.8 79.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.495 -0.753 . . . . 0.0 109.944 179.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.494 ' O ' ' N ' ' A' ' 32' ' ' ARG . 91.8 p -58.41 -40.14 81.65 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.235 -0.916 . . . . 0.0 109.262 179.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.519 ' OE2' ' CD2' ' A' ' 33' ' ' HIS . 51.6 tp10 -64.26 -54.65 30.0 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.86 -45.99 78.36 Favored 'General case' 0 C--N 1.303 -1.421 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.645 HG23 ' O ' ' A' ' 27' ' ' LYS . 81.9 t -64.41 -28.7 45.45 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 178.213 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.494 ' N ' ' O ' ' A' ' 28' ' ' SER . 10.7 mtp180 -80.63 -28.33 36.99 Favored 'General case' 0 N--CA 1.488 1.469 0 CA-C-O 121.559 0.695 . . . . 0.0 109.477 179.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.519 ' CD2' ' OE2' ' A' ' 29' ' ' GLU . 23.1 m-70 . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 118.044 -0.979 . . . . 0.0 110.207 -178.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.439 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.671 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.569 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 98.4 mt-10 -124.27 47.64 2.0 Favored Pre-proline 0 N--CA 1.491 1.615 0 O-C-N 121.129 -0.982 . . . . 0.0 110.695 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.3 Cg_endo -74.88 -26.23 11.38 Favored 'Trans proline' 0 C--N 1.305 -1.752 0 O-C-N 123.849 1.447 . . . . 0.0 110.247 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.55 ' CE1' ' OD1' ' A' ' 16' ' ' ASN . 53.5 p90 -73.68 -33.46 64.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.312 -0.867 . . . . 0.0 110.639 -179.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.754 ' HA ' HD13 ' A' ' 20' ' ' LEU . 69.1 m-20 -61.42 -13.57 21.3 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.081 -1.012 . . . . 0.0 110.528 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -82.9 -42.43 17.72 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.117 -0.99 . . . . 0.0 110.804 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.543 ' CD2' ' N ' ' A' ' 19' ' ' THR . 65.3 p-90 -111.83 -44.1 3.52 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.878 -1.138 . . . . 0.0 110.43 179.643 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.543 ' N ' ' CD2' ' A' ' 18' ' ' TRP . 17.3 m -43.52 -46.14 6.84 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.249 -0.907 . . . . 0.0 109.966 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.754 HD13 ' HA ' ' A' ' 16' ' ' ASN . 6.5 mp -51.5 -56.13 15.09 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.226 -0.921 . . . . 0.0 110.035 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.483 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 53.5 tt0 -51.86 -37.72 53.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.195 -0.941 . . . . 0.0 109.976 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.448 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 0.5 OUTLIER -64.58 -36.96 85.93 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 120.962 -1.086 . . . . 0.0 109.37 179.707 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.848 HD23 HD12 ' A' ' 26' ' ' LEU . 75.2 mt -75.23 -25.82 58.41 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.692 -0.803 . . . . 0.0 109.522 179.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 74.0 mt-10 -51.5 -23.14 3.7 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.425 -0.954 . . . . 0.0 108.425 178.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.448 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 8.9 pt-20 -82.26 -21.42 36.25 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 178.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.848 HD12 HD23 ' A' ' 23' ' ' LEU . 33.4 mt -89.73 -32.52 16.96 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.565 ' O ' HG23 ' A' ' 31' ' ' VAL . 2.4 ttpm? -64.46 -40.0 94.87 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.497 -0.752 . . . . 0.0 110.141 179.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.471 ' O ' ' N ' ' A' ' 32' ' ' ARG . 79.5 p -58.43 -40.49 82.67 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.203 -0.936 . . . . 0.0 109.288 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.499 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 22.7 tp10 -64.25 -53.75 44.21 Favored 'General case' 0 C--N 1.304 -1.407 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.616 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.36 -44.68 76.23 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 178.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.565 HG23 ' O ' ' A' ' 27' ' ' LYS . 74.4 t -65.8 -28.4 43.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 178.176 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.499 ' HB2' ' HA ' ' A' ' 29' ' ' GLU . 10.5 mtt-85 -78.38 -24.62 46.26 Favored 'General case' 0 N--CA 1.487 1.393 0 CA-C-O 121.448 0.642 . . . . 0.0 109.591 179.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 42.0 m-70 . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.26 -179.482 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.448 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.75 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.584 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 60.3 mp0 -123.24 45.31 1.1 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 121.101 -0.999 . . . . 0.0 110.466 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.584 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 52.7 Cg_endo -75.56 -24.01 12.37 Favored 'Trans proline' 0 C--N 1.307 -1.642 0 O-C-N 123.765 1.402 . . . . 0.0 109.954 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.5 ' CD1' ' C ' ' A' ' 15' ' ' TYR . 16.0 p90 -83.97 -22.47 31.42 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.36 -0.838 . . . . 0.0 110.525 -179.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.531 ' HB3' ' CD1' ' A' ' 20' ' ' LEU . 14.2 m120 -51.36 -51.0 58.43 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.165 -0.959 . . . . 0.0 110.305 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.3 pt-20 -64.99 -27.34 68.76 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.172 -0.955 . . . . 0.0 110.571 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.52 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 8.3 t90 -76.38 -31.98 58.31 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.111 -0.993 . . . . 0.0 110.415 -179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.49 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.3 OUTLIER -100.4 -43.38 6.26 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.152 -0.967 . . . . 0.0 110.142 -179.691 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.531 ' CD1' ' HB3' ' A' ' 16' ' ' ASN . 82.0 mt -47.89 -40.64 22.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 120.897 -1.127 . . . . 0.0 109.451 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.481 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 83.8 tt0 -66.22 -33.77 76.5 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.346 -0.847 . . . . 0.0 109.943 179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.576 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.7 OUTLIER -60.17 -28.72 68.16 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -0.949 . . . . 0.0 109.021 179.541 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 1.035 HD23 HD12 ' A' ' 26' ' ' LEU . 83.2 mt -94.84 -23.43 17.48 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.491 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 48.3 mm-40 -49.39 -32.66 11.96 Favored 'General case' 0 N--CA 1.485 1.318 0 N-CA-C 108.334 -0.987 . . . . 0.0 108.334 179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.469 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 20.9 pt-20 -80.06 -21.72 43.11 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.699 -0.801 . . . . 0.0 109.15 178.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.035 HD12 HD23 ' A' ' 23' ' ' LEU . 18.9 mt -82.46 -33.73 28.35 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.369 -0.832 . . . . 0.0 109.369 179.352 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 2.8 ttpm? -61.29 -47.12 87.4 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.382 -0.824 . . . . 0.0 109.535 179.328 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 92.7 p -56.45 -36.84 69.5 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.595 -0.842 . . . . 0.0 108.832 179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.495 ' O ' ' N ' ' A' ' 33' ' ' HIS . 89.6 mt-10 -65.81 -55.32 17.76 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 178.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.43 -45.55 80.7 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.215 -1.032 . . . . 0.0 108.215 178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.1 t -64.28 -27.56 42.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 178.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.522 ' CG ' ' O ' ' A' ' 28' ' ' SER . 9.9 mtp180 -81.77 -32.6 31.36 Favored 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.604 0.716 . . . . 0.0 109.475 179.036 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.495 ' N ' ' O ' ' A' ' 29' ' ' GLU . 20.1 m-70 . . . . . 0 N--CA 1.489 1.503 0 CA-C-O 117.94 -1.028 . . . . 0.0 110.023 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.452 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.679 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 92.6 mt-10 -123.78 48.54 2.26 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.248 -0.908 . . . . 0.0 110.265 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 46.6 Cg_endo -72.47 -33.13 9.1 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.972 1.511 . . . . 0.0 110.484 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.63 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 42.1 p90 -62.88 -35.99 81.83 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.305 -0.872 . . . . 0.0 110.311 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.63 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 16.8 m120 -44.84 -45.38 10.15 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.249 -0.907 . . . . 0.0 109.582 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 88.1 tt0 -70.82 -22.41 62.34 Favored 'General case' 0 C--N 1.302 -1.484 0 O-C-N 121.202 -0.936 . . . . 0.0 109.572 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.501 ' N ' ' O ' ' A' ' 15' ' ' TYR . 26.8 t90 -85.9 -40.96 15.37 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.306 -0.872 . . . . 0.0 110.182 179.704 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.5 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -77.89 -44.24 27.7 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.167 -0.958 . . . . 0.0 109.805 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.629 HD22 ' O ' ' A' ' 16' ' ' ASN . 2.0 mp -55.07 -49.78 70.78 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 120.996 -1.065 . . . . 0.0 108.587 178.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.491 ' HA ' ' HB2' ' A' ' 24' ' ' GLU . 39.6 tt0 -68.22 -27.0 65.99 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.497 -0.752 . . . . 0.0 109.277 178.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.796 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.1 tm? -57.27 -40.09 76.98 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.382 -0.824 . . . . 0.0 109.197 179.268 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.773 ' CD2' HD12 ' A' ' 26' ' ' LEU . 89.4 mt -92.23 -21.2 20.47 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.511 -0.743 . . . . 0.0 109.888 179.592 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.5 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 26.1 mm-40 -50.64 -22.38 2.01 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.246 -0.908 . . . . 0.0 108.906 179.428 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.414 ' OE2' ' O ' ' A' ' 22' ' ' LEU . 18.4 pt-20 -82.93 -26.93 30.95 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 178.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.773 HD12 ' CD2' ' A' ' 23' ' ' LEU . 54.8 mt -80.9 -34.06 33.8 Favored 'General case' 0 N--CA 1.488 1.432 0 O-C-N 121.463 -0.773 . . . . 0.0 109.105 179.026 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.502 ' O ' HG23 ' A' ' 31' ' ' VAL . 9.5 ttpp -59.26 -46.55 88.21 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.486 -0.759 . . . . 0.0 109.441 179.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.3 m -57.7 -42.05 82.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.568 -0.853 . . . . 0.0 108.737 179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 92.9 mt-10 -62.05 -52.72 62.8 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 108.108 -1.071 . . . . 0.0 108.108 178.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.99 -47.31 83.38 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 27' ' ' LYS . 69.2 t -62.24 -29.98 47.85 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.425 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 178.048 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 28' ' ' SER . 57.8 mtt180 -75.46 -28.85 59.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-O 121.559 0.695 . . . . 0.0 109.506 179.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.9 m-70 . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 117.98 -1.01 . . . . 0.0 109.989 -179.457 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.435 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.727 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.576 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 93.2 mt-10 -123.84 47.55 1.85 Allowed Pre-proline 0 N--CA 1.491 1.584 0 O-C-N 121.195 -0.94 . . . . 0.0 110.311 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.4 Cg_endo -73.65 -28.96 11.23 Favored 'Trans proline' 0 C--N 1.306 -1.703 0 O-C-N 123.854 1.449 . . . . 0.0 109.947 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.57 ' CZ ' ' OD1' ' A' ' 16' ' ' ASN . 52.8 p90 -71.17 -23.84 62.13 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.324 -0.86 . . . . 0.0 110.261 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.622 ' O ' HD22 ' A' ' 20' ' ' LEU . 19.0 m120 -64.36 -15.46 60.46 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.18 -0.95 . . . . 0.0 110.493 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -81.87 -41.46 20.94 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.09 -1.006 . . . . 0.0 110.804 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.566 ' NE1' ' HA ' ' A' ' 15' ' ' TYR . 65.6 p-90 -110.62 -44.39 3.68 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.91 -1.119 . . . . 0.0 111.094 -179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.594 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 43.3 m -42.15 -53.03 4.17 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.134 -0.979 . . . . 0.0 110.049 -179.58 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.622 HD22 ' O ' ' A' ' 16' ' ' ASN . 7.0 mp -47.41 -52.58 16.43 Favored 'General case' 0 N--CA 1.487 1.376 0 O-C-N 121.016 -1.053 . . . . 0.0 108.466 179.073 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 84.2 tt0 -68.91 -28.02 66.29 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 178.468 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.753 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.4 tm? -65.36 -33.53 76.17 Favored 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 178.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 26' ' ' LEU . 87.3 mt -94.16 -18.22 21.96 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.535 -0.728 . . . . 0.0 109.769 179.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.506 ' O ' ' HG2' ' A' ' 27' ' ' LYS . 5.7 mt-10 -51.75 -21.44 2.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.064 -1.022 . . . . 0.0 109.127 179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -80.59 -23.57 39.76 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.487 ' HA ' HD23 ' A' ' 26' ' ' LEU . 18.7 mt -91.8 -36.77 13.35 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.517 -0.739 . . . . 0.0 109.572 179.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.551 ' HG3' ' N ' ' A' ' 28' ' ' SER . 13.6 pttp -60.21 -38.43 83.31 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 0.0 109.799 179.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.551 ' N ' ' HG3' ' A' ' 27' ' ' LYS . 30.0 m -67.06 -33.5 75.65 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.291 -0.88 . . . . 0.0 109.488 179.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.442 ' O ' ' N ' ' A' ' 33' ' ' HIS . 95.2 mt-10 -63.99 -55.85 19.34 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 178.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.01 -42.53 76.59 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.178 -0.951 . . . . 0.0 108.555 178.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.0 t -68.04 -28.24 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 N-CA-C 108.542 -0.91 . . . . 0.0 108.542 178.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.468 ' N ' ' O ' ' A' ' 28' ' ' SER . 5.1 mtp180 -81.11 -25.28 37.08 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 121.546 0.688 . . . . 0.0 109.477 179.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.442 ' N ' ' O ' ' A' ' 29' ' ' GLU . 29.5 m-70 . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.017 -0.992 . . . . 0.0 110.184 -179.525 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.451 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.726 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.57 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 57.1 mm-40 -123.15 46.44 1.35 Allowed Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.264 -0.898 . . . . 0.0 110.358 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.57 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 49.5 Cg_endo -74.89 -56.72 0.06 OUTLIER 'Trans proline' 0 C--N 1.307 -1.607 0 O-C-N 123.759 1.399 . . . . 0.0 110.282 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.536 ' O ' ' CB ' ' A' ' 18' ' ' TRP . 2.3 p90 -50.65 -29.39 10.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.355 -0.84 . . . . 0.0 110.872 -179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.531 ' ND2' ' O ' ' A' ' 13' ' ' GLU . 17.5 m120 40.6 69.06 0.35 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.182 -0.949 . . . . 0.0 110.11 -179.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.476 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 80.7 mt-10 59.43 18.67 7.05 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.712 -0.617 . . . . 0.0 110.664 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.536 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 18.3 t90 -70.31 -43.93 69.34 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.026 -1.046 . . . . 0.0 109.72 179.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.45 ' N ' ' CE3' ' A' ' 18' ' ' TRP . 3.1 m -63.03 -41.35 99.5 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.348 -0.845 . . . . 0.0 110.014 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.597 HD12 ' N ' ' A' ' 20' ' ' LEU . 8.4 mp -60.97 -46.21 91.65 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.261 -0.899 . . . . 0.0 109.602 179.662 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 27.7 tt0 -62.33 -35.34 78.78 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.336 -0.852 . . . . 0.0 109.972 179.66 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -39.9 95.14 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.176 -0.952 . . . . 0.0 109.606 179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 1.067 HD23 HD12 ' A' ' 26' ' ' LEU . 91.9 mt -71.52 -28.3 63.8 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.379 -0.826 . . . . 0.0 109.937 179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.468 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 95.1 mt-10 -51.09 -22.95 2.73 Favored 'General case' 0 C--N 1.304 -1.411 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -79.39 -25.39 42.15 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 178.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 1.067 HD12 HD23 ' A' ' 23' ' ' LEU . 62.8 mt -82.23 -40.96 20.89 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.96 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.56 ' O ' HG23 ' A' ' 31' ' ' VAL . 1.6 ttpm? -58.52 -44.77 89.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.515 -0.74 . . . . 0.0 109.22 179.072 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 89.9 p -58.94 -37.35 76.52 Favored 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.519 ' OE1' HD23 ' A' ' 26' ' ' LEU . 94.3 mt-10 -63.78 -53.04 57.09 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 178.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.11 -47.4 83.39 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.56 HG23 ' O ' ' A' ' 27' ' ' LYS . 96.9 t -63.12 -28.41 45.01 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 178.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 28' ' ' SER . 12.7 mtt85 -76.77 -34.48 58.01 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-O 121.598 0.713 . . . . 0.0 109.435 178.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 34.0 m-70 . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 117.974 -1.013 . . . . 0.0 109.899 -179.38 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.46 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.675 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.517 ' HA ' ' CE2' ' A' ' 15' ' ' TYR . 95.2 mt-10 -121.08 52.42 2.89 Favored Pre-proline 0 N--CA 1.489 1.501 0 O-C-N 121.229 -0.919 . . . . 0.0 110.197 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.509 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 45.0 Cg_endo -71.24 -26.34 21.07 Favored 'Trans proline' 0 C--N 1.304 -1.769 0 O-C-N 124.012 1.533 . . . . 0.0 110.65 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.557 ' HA ' ' CE2' ' A' ' 18' ' ' TRP . 54.3 p90 -68.71 -29.36 67.77 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.18 -0.95 . . . . 0.0 110.448 -179.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.682 ' O ' HD22 ' A' ' 20' ' ' LEU . 59.9 m-20 -61.04 -16.45 43.7 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.162 -0.961 . . . . 0.0 110.478 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 95.0 mt-10 -78.46 -40.37 35.8 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.166 -0.959 . . . . 0.0 110.759 -179.279 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.557 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 62.5 p-90 -114.49 -37.76 4.22 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.982 -1.074 . . . . 0.0 110.597 179.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.573 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 60.4 m -49.69 -47.04 50.56 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.015 -1.053 . . . . 0.0 109.885 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.682 HD22 ' O ' ' A' ' 16' ' ' ASN . 5.3 mp -51.1 -52.97 38.48 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.988 -1.07 . . . . 0.0 109.117 179.332 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 75.3 tt0 -73.78 -15.76 61.18 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.0 109.22 178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.725 HD13 ' C ' ' A' ' 22' ' ' LEU . 3.4 tm? -73.69 -33.69 64.53 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.429 -0.794 . . . . 0.0 109.47 179.563 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.947 HD23 HD12 ' A' ' 26' ' ' LEU . 34.4 mt -98.22 -19.41 17.87 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.49 -0.757 . . . . 0.0 109.661 179.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 11.3 mm-40 -49.14 -27.07 3.2 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.326 -0.859 . . . . 0.0 108.843 179.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 17.4 pt-20 -83.35 -22.25 32.9 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.57 -0.706 . . . . 0.0 109.319 178.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.947 HD12 HD23 ' A' ' 23' ' ' LEU . 27.8 mt -85.83 -27.98 24.76 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.38 -0.825 . . . . 0.0 109.277 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.505 ' O ' HG23 ' A' ' 31' ' ' VAL . 19.4 ttpp -61.35 -47.43 85.89 Favored 'General case' 0 N--CA 1.488 1.442 0 O-C-N 121.465 -0.772 . . . . 0.0 109.35 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.522 ' O ' ' CD ' ' A' ' 32' ' ' ARG . 87.5 p -56.51 -38.75 72.21 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.711 ' OE1' HD23 ' A' ' 26' ' ' LEU . 96.3 mt-10 -64.9 -56.47 13.12 Favored 'General case' 0 C--N 1.305 -1.349 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 178.552 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.2 -45.51 79.83 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 27' ' ' LYS . 78.4 t -65.22 -28.27 44.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.456 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.522 ' CD ' ' O ' ' A' ' 28' ' ' SER . 3.7 mtp180 -79.41 -32.88 42.98 Favored 'General case' 0 N--CA 1.488 1.459 0 CA-C-O 121.619 0.723 . . . . 0.0 109.384 178.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.438 ' N ' ' O ' ' A' ' 29' ' ' GLU . 26.4 m-70 . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.156 -179.139 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.456 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.756 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.526 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.8 mt-10 -121.61 50.77 2.42 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.189 -0.944 . . . . 0.0 110.634 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 44.6 Cg_endo -72.5 -29.1 13.83 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 O-C-N 124.038 1.546 . . . . 0.0 110.119 179.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.615 ' CE1' ' ND2' ' A' ' 16' ' ' ASN . 12.7 p90 -78.64 -24.12 45.42 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.441 -0.787 . . . . 0.0 110.201 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.615 ' ND2' ' CE1' ' A' ' 15' ' ' TYR . 26.1 m120 -63.58 -20.8 65.95 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.395 -0.816 . . . . 0.0 111.022 -179.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -86.13 -49.65 7.6 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.933 -1.104 . . . . 0.0 111.218 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.577 ' CH2' ' OG1' ' A' ' 19' ' ' THR . 60.8 p-90 -113.86 -48.48 2.91 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.862 -1.149 . . . . 0.0 110.954 -179.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.577 ' OG1' ' CH2' ' A' ' 18' ' ' TRP . 58.5 m -56.67 -32.77 65.73 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 120.982 -1.074 . . . . 0.0 109.579 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.512 ' N ' ' O ' ' A' ' 15' ' ' TYR . 9.2 tp -45.28 -51.78 10.48 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.511 -0.743 . . . . 0.0 109.927 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.494 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 72.1 tt0 -67.04 -30.78 70.96 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.154 -0.967 . . . . 0.0 110.231 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.51 -38.3 74.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.95 -1.094 . . . . 0.0 109.641 179.763 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.675 ' CD2' HD12 ' A' ' 26' ' ' LEU . 55.0 mt -64.91 -24.23 67.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.261 -0.9 . . . . 0.0 109.844 179.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.494 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 95.4 mt-10 -51.42 -22.58 3.11 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.115 -1.034 . . . . 0.0 108.433 179.313 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 64.4 mm-40 -77.57 -26.16 50.62 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 178.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.675 HD12 ' CD2' ' A' ' 23' ' ' LEU . 19.6 mt -83.72 -36.99 23.26 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.412 0.625 . . . . 0.0 109.399 179.081 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.564 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.7 ttpm? -60.03 -45.69 91.96 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.397 -0.814 . . . . 0.0 109.44 179.302 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.459 ' O ' ' N ' ' A' ' 32' ' ' ARG . 22.6 t -56.18 -38.26 70.7 Favored 'General case' 0 N--CA 1.487 1.42 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 179.372 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.474 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 78.2 mt-10 -64.74 -55.1 21.96 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.061 -1.088 . . . . 0.0 108.061 178.176 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.69 -44.07 77.0 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 178.326 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.564 HG21 ' HE2' ' A' ' 27' ' ' LYS . 41.8 t -66.15 -27.28 40.32 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.299 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.474 ' HB2' ' HA ' ' A' ' 29' ' ' GLU . 36.0 mtt-85 -78.66 -34.11 46.62 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-O 121.538 0.685 . . . . 0.0 109.471 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' A' ' 29' ' ' GLU . 35.5 m-70 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.203 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.433 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.214 -0.793 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.538 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 98.4 mt-10 -125.21 49.88 3.76 Favored Pre-proline 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.986 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 44.3 Cg_endo -72.53 -30.73 11.89 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 124.094 1.576 . . . . 0.0 110.061 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.634 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 53.8 p90 -66.71 -44.23 82.19 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.259 -0.901 . . . . 0.0 110.1 179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.634 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 22.0 m120 41.95 -87.12 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.614 -0.679 . . . . 0.0 111.09 179.915 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' A' ' 15' ' ' TYR . 0.1 OUTLIER -89.46 -11.4 43.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.263 -0.898 . . . . 0.0 111.249 -179.238 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.443 ' CE3' ' N ' ' A' ' 19' ' ' THR . 55.4 t90 -62.84 -52.58 62.58 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.786 -1.196 . . . . 0.0 110.315 -179.682 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.579 ' OG1' ' CD1' ' A' ' 15' ' ' TYR . 1.8 m -61.22 -40.82 95.43 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.056 -1.028 . . . . 0.0 109.856 179.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.473 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 36.1 mt -48.11 -32.9 7.45 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.14 -0.975 . . . . 0.0 109.698 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.551 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 88.0 tt0 -75.71 -26.4 57.5 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.319 -0.863 . . . . 0.0 109.733 179.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.559 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.8 OUTLIER -66.53 -41.47 88.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.215 -0.928 . . . . 0.0 109.325 179.498 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.901 HD23 HD12 ' A' ' 26' ' ' LEU . 88.7 mt -68.92 -22.89 64.13 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.346 -0.846 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.551 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 65.6 mm-40 -50.25 -30.71 12.33 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.196 -1.001 . . . . 0.0 108.415 178.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 8.9 mm-40 -78.34 -24.32 46.57 Favored 'General case' 0 N--CA 1.486 1.332 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 178.698 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.901 HD12 HD23 ' A' ' 23' ' ' LEU . 40.8 mt -87.22 -27.72 22.8 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.603 -0.685 . . . . 0.0 109.26 179.166 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.708 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.6 ttpm? -63.91 -48.26 77.3 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.502 -0.749 . . . . 0.0 109.39 179.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.493 ' O ' ' N ' ' A' ' 32' ' ' ARG . 23.0 t -55.91 -38.38 70.16 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.335 -0.853 . . . . 0.0 108.878 179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.416 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 71.8 mm-40 -64.39 -55.77 18.79 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 178.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.68 -44.16 81.18 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 178.488 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.708 HG21 ' HE2' ' A' ' 27' ' ' LYS . 77.2 t -66.66 -25.47 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 178.189 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.493 ' N ' ' O ' ' A' ' 28' ' ' SER . 65.8 mtt180 -81.03 -22.57 39.26 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-O 121.497 0.665 . . . . 0.0 109.456 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 42.5 m-70 . . . . . 0 N--CA 1.488 1.466 0 CA-C-O 118.032 -0.985 . . . . 0.0 110.148 -179.359 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.468 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.699 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.592 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 58.7 mp0 -120.9 44.77 0.75 Allowed Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.253 -0.904 . . . . 0.0 110.651 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.592 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.5 Cg_endo -74.4 -40.94 0.97 Allowed 'Trans proline' 0 C--N 1.307 -1.637 0 O-C-N 123.785 1.413 . . . . 0.0 109.984 179.712 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 26.3 p90 -60.01 -30.04 68.89 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.365 -0.834 . . . . 0.0 110.158 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.557 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 21.2 m120 -45.84 -55.48 6.59 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.271 -0.893 . . . . 0.0 110.16 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 98.9 mt-10 -64.31 -33.26 75.42 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.234 -0.916 . . . . 0.0 110.28 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.468 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 37.5 t90 -70.02 -45.0 68.13 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.145 -0.972 . . . . 0.0 110.088 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.515 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -81.83 -52.22 7.34 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.147 -0.971 . . . . 0.0 110.343 -179.796 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.483 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 88.2 mt -44.28 -45.03 8.43 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.104 -0.997 . . . . 0.0 109.171 179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 88.2 tt0 -74.5 -27.23 60.46 Favored 'General case' 0 N--CA 1.488 1.443 0 O-C-N 121.364 -0.835 . . . . 0.0 108.792 178.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.768 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.4 tm? -65.48 -37.47 86.92 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.592 -0.692 . . . . 0.0 109.515 179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.876 HD23 HD12 ' A' ' 26' ' ' LEU . 92.2 mt -92.31 -19.3 22.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.406 -0.808 . . . . 0.0 109.987 179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 7.9 mm-40 -49.51 -23.76 1.75 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.152 -0.968 . . . . 0.0 108.849 179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 70.0 mm-40 -78.57 -29.9 46.5 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 178.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.876 HD12 HD23 ' A' ' 23' ' ' LEU . 63.8 mt -79.55 -33.96 41.43 Favored 'General case' 0 N--CA 1.486 1.34 0 O-C-N 121.577 -0.702 . . . . 0.0 109.203 179.023 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.489 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.3 ttpm? -62.8 -48.14 80.4 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.408 -0.808 . . . . 0.0 109.366 179.281 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.467 ' O ' ' N ' ' A' ' 32' ' ' ARG . 58.2 m -55.1 -36.35 65.58 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 119.635 -0.826 . . . . 0.0 108.906 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.494 ' OE1' HD23 ' A' ' 26' ' ' LEU . 95.5 mt-10 -65.01 -55.53 18.41 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.569 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.45 -46.56 80.28 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 178.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.489 HG21 ' HE2' ' A' ' 27' ' ' LYS . 71.0 t -63.2 -29.09 46.38 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 0.0 108.48 178.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.8 mtt-85 -77.83 -30.7 51.24 Favored 'General case' 0 N--CA 1.488 1.454 0 CA-C-O 121.646 0.736 . . . . 0.0 109.544 179.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.416 ' N ' ' O ' ' A' ' 29' ' ' GLU . 31.7 m-70 . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.138 -179.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.464 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.702 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 92.8 mt-10 -122.43 49.63 2.29 Favored Pre-proline 0 N--CA 1.491 1.585 0 O-C-N 121.228 -0.92 . . . . 0.0 110.148 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.555 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.3 Cg_endo -71.98 -15.58 29.28 Favored 'Trans proline' 0 C--N 1.304 -1.789 0 O-C-N 124.053 1.554 . . . . 0.0 110.784 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.516 ' CE2' ' HA ' ' A' ' 13' ' ' GLU . 43.1 p90 -83.45 -11.79 57.1 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.27 -0.894 . . . . 0.0 110.75 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.499 ' OD1' ' HB3' ' A' ' 13' ' ' GLU . 13.4 m120 -40.35 -26.9 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.393 -0.817 . . . . 0.0 110.435 -179.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.477 ' N ' ' O ' ' A' ' 15' ' ' TYR . 95.4 mt-10 -112.36 -25.84 9.04 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.072 -1.018 . . . . 0.0 110.573 -179.687 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.499 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 9.9 t90 -72.94 -34.94 66.87 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.157 -0.964 . . . . 0.0 110.603 -179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.491 ' O ' ' HB2' ' A' ' 22' ' ' LEU . 0.5 OUTLIER -97.89 -29.09 13.53 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.999 -1.063 . . . . 0.0 110.481 -179.537 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.592 HD22 ' N ' ' A' ' 20' ' ' LEU . 4.1 mm? -64.11 -38.9 92.74 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 120.899 -1.126 . . . . 0.0 109.139 179.68 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.411 ' HA ' ' HB2' ' A' ' 24' ' ' GLU . 77.5 tt0 -64.98 -31.26 72.41 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.493 -0.755 . . . . 0.0 109.613 179.165 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.536 ' N ' ' CD2' ' A' ' 22' ' ' LEU . 0.6 OUTLIER -59.79 -41.67 91.66 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.285 -0.884 . . . . 0.0 109.431 179.358 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.601 ' N ' HD12 ' A' ' 23' ' ' LEU . 10.4 mp -83.67 -27.11 29.3 Favored 'General case' 0 C--N 1.303 -1.442 0 O-C-N 121.316 -0.865 . . . . 0.0 109.241 179.031 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.3 mm-40 -50.19 -27.46 5.93 Favored 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 179.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.522 ' CG ' ' O ' ' A' ' 22' ' ' LEU . 1.3 pt-20 -89.44 -14.61 35.02 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.639 -0.824 . . . . 0.0 109.398 178.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 23' ' ' LEU . 72.1 mt -83.59 -38.7 21.29 Favored 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.271 -0.893 . . . . 0.0 109.17 179.097 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.609 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.9 ttpm? -60.72 -48.07 83.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.194 -0.941 . . . . 0.0 109.304 179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.513 ' O ' ' N ' ' A' ' 32' ' ' ARG . 99.2 p -54.7 -36.2 64.44 Favored 'General case' 0 N--CA 1.486 1.346 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.485 ' HB2' ' O ' ' A' ' 26' ' ' LEU . 70.2 mm-40 -64.85 -54.96 22.82 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 178.51 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.88 -45.28 78.61 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 178.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.609 HG21 ' HE2' ' A' ' 27' ' ' LYS . 99.3 t -64.78 -30.63 50.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 178.012 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.513 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.0 mtt180 -76.07 -27.25 57.16 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 121.53 0.681 . . . . 0.0 109.545 179.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.427 ' N ' ' O ' ' A' ' 29' ' ' GLU . 34.0 m-70 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.996 -1.002 . . . . 0.0 109.992 -179.63 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.467 ' C ' ' CD ' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.711 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.583 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 90.9 mt-10 -121.41 47.1 1.2 Allowed Pre-proline 0 N--CA 1.492 1.625 0 O-C-N 121.219 -0.926 . . . . 0.0 110.417 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.5 Cg_endo -71.87 -5.02 16.23 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 123.884 1.465 . . . . 0.0 110.705 179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.566 ' HA ' ' HB3' ' A' ' 18' ' ' TRP . 31.0 p90 -106.62 1.7 25.41 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.306 -0.871 . . . . 0.0 110.709 -179.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.51 ' O ' ' CD1' ' A' ' 20' ' ' LEU . 7.9 m120 -30.53 -50.15 0.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 CA-C-O 121.046 0.45 . . . . 0.0 111.665 -179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.492 ' HA ' HD12 ' A' ' 20' ' ' LEU . 98.2 mt-10 -115.01 -17.39 11.49 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.113 -0.992 . . . . 0.0 110.807 -179.392 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.566 ' HB3' ' HA ' ' A' ' 15' ' ' TYR . 67.0 t90 -58.97 -49.84 76.34 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.158 -0.964 . . . . 0.0 109.969 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.457 ' OG1' ' HB2' ' A' ' 15' ' ' TYR . 0.2 OUTLIER -68.65 -36.42 78.56 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.264 -0.898 . . . . 0.0 110.055 179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.51 ' CD1' ' O ' ' A' ' 16' ' ' ASN . 74.6 mt -60.7 -42.07 96.45 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.328 -0.858 . . . . 0.0 110.206 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.508 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 50.8 tt0 -69.43 -37.43 77.41 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.156 -0.965 . . . . 0.0 110.008 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.53 -42.75 97.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.024 -1.048 . . . . 0.0 109.638 179.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.914 HD23 HD12 ' A' ' 26' ' ' LEU . 80.0 mt -64.64 -25.13 67.82 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.278 -0.889 . . . . 0.0 109.949 179.755 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.508 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 82.0 mt-10 -49.6 -25.78 3.07 Favored 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 119.076 -1.05 . . . . 0.0 108.368 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 54.9 mt-10 -76.36 -26.71 55.96 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 108.756 -0.831 . . . . 0.0 108.756 178.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.914 HD12 HD23 ' A' ' 23' ' ' LEU . 25.2 mt -81.95 -37.07 27.28 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.576 -0.702 . . . . 0.0 109.204 178.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.646 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.4 ttpm? -59.86 -46.31 89.69 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.423 -0.798 . . . . 0.0 109.358 179.416 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.496 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.2 m -56.55 -38.12 71.48 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.809 -0.812 . . . . 0.0 108.809 179.319 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.445 ' O ' ' N ' ' A' ' 33' ' ' HIS . 61.6 mm-40 -65.41 -56.6 11.59 Favored 'General case' 0 C--N 1.306 -1.324 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 178.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.11 -44.86 79.51 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 108.226 -1.027 . . . . 0.0 108.226 178.337 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.646 HG21 ' HE2' ' A' ' 27' ' ' LYS . 53.9 t -64.67 -30.49 50.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 178.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' A' ' 28' ' ' SER . 13.5 mtp180 -76.22 -33.23 59.23 Favored 'General case' 0 N--CA 1.488 1.473 0 CA-C-O 121.656 0.741 . . . . 0.0 109.334 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.445 ' N ' ' O ' ' A' ' 29' ' ' GLU . 23.7 m-70 . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 117.952 -1.023 . . . . 0.0 110.226 -179.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.464 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.664 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.577 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 51.6 mt-10 -121.86 47.23 1.32 Allowed Pre-proline 0 N--CA 1.489 1.507 0 O-C-N 121.21 -0.931 . . . . 0.0 110.498 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.577 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 45.6 Cg_endo -73.02 -40.84 1.57 Allowed 'Trans proline' 0 C--N 1.307 -1.639 0 O-C-N 123.949 1.499 . . . . 0.0 110.129 179.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.635 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 18.2 p90 -67.41 -31.53 71.8 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.271 -0.893 . . . . 0.0 110.123 179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.635 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 20.9 m120 -47.74 -53.34 15.5 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.295 -0.878 . . . . 0.0 109.706 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 77.6 tt0 -62.18 -29.82 70.63 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.32 -0.863 . . . . 0.0 109.871 179.699 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 37.6 t90 -76.22 -46.76 26.72 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.263 -0.898 . . . . 0.0 110.154 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -78.24 -50.93 10.96 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.101 -0.999 . . . . 0.0 109.933 -179.76 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.471 ' O ' ' HG2' ' A' ' 24' ' ' GLU . 93.0 mt -46.4 -51.19 15.49 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.127 -0.983 . . . . 0.0 109.241 179.317 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.471 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 67.8 tt0 -59.71 -28.33 67.24 Favored 'General case' 0 N--CA 1.487 1.421 0 O-C-N 121.474 -0.766 . . . . 0.0 109.617 179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.531 ' O ' ' HG2' ' A' ' 25' ' ' GLU . 16.6 tp -65.39 -37.71 87.79 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.198 -0.939 . . . . 0.0 109.389 179.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.636 ' N ' HD12 ' A' ' 23' ' ' LEU . 9.0 mp -80.93 -25.84 37.15 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.255 -0.978 . . . . 0.0 108.84 178.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 21' ' ' GLU . 54.0 mm-40 -50.9 -29.09 11.09 Favored 'General case' 0 N--CA 1.485 1.303 0 N-CA-C 108.28 -1.008 . . . . 0.0 108.28 178.753 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 0.4 OUTLIER -87.99 -21.01 25.07 Favored 'General case' 0 N--CA 1.487 1.399 0 N-CA-C 108.858 -0.793 . . . . 0.0 108.858 178.411 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.632 HD12 ' HA ' ' A' ' 23' ' ' LEU . 77.4 mt -77.05 -35.66 56.58 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 108.883 -0.784 . . . . 0.0 108.883 178.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.493 ' O ' HG23 ' A' ' 31' ' ' VAL . 2.0 ttpm? -59.59 -45.62 91.35 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.477 -0.764 . . . . 0.0 109.25 179.312 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.503 ' O ' ' N ' ' A' ' 32' ' ' ARG . 68.7 m -57.84 -42.2 83.91 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.579 -0.897 . . . . 0.0 108.579 179.175 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 91.1 mt-10 -63.02 -53.93 46.11 Favored 'General case' 0 C--N 1.305 -1.33 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 178.114 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.0 -45.54 75.08 Favored 'General case' 0 C--N 1.304 -1.387 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 178.193 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 27' ' ' LYS . 55.7 t -64.69 -31.98 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.414 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 178.062 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.503 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.7 mtt-85 -72.55 -27.36 62.16 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.497 0.665 . . . . 0.0 109.411 178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 39.7 m-70 . . . . . 0 N--CA 1.49 1.549 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.166 -179.48 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.426 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.214 -0.772 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.576 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 98.4 mt-10 -123.23 46.64 1.41 Allowed Pre-proline 0 N--CA 1.492 1.641 0 O-C-N 121.288 -0.883 . . . . 0.0 110.383 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.576 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.5 Cg_endo -72.83 -32.32 9.24 Favored 'Trans proline' 0 C--N 1.305 -1.714 0 O-C-N 123.939 1.494 . . . . 0.0 110.239 179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.575 ' CE1' ' OD1' ' A' ' 16' ' ' ASN . 54.1 p90 -63.81 -32.27 73.72 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.303 -0.873 . . . . 0.0 109.965 179.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.872 ' O ' HD22 ' A' ' 20' ' ' LEU . 50.2 m-20 -59.05 -17.08 22.38 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.181 -0.95 . . . . 0.0 110.089 179.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 90.5 mt-10 -74.84 -43.23 55.66 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.139 -0.975 . . . . 0.0 110.327 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.557 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 60.5 p-90 -111.53 -39.26 4.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.92 -1.113 . . . . 0.0 110.218 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.586 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 77.0 m -48.36 -45.14 35.23 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.2 -0.938 . . . . 0.0 109.842 -179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.872 HD22 ' O ' ' A' ' 16' ' ' ASN . 3.3 mp -52.14 -50.36 61.9 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.197 -0.939 . . . . 0.0 109.065 179.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.422 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 60.4 tt0 -74.24 -17.19 60.91 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.236 -0.915 . . . . 0.0 108.854 178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.734 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.4 tm? -75.78 -33.28 60.17 Favored 'General case' 0 N--CA 1.491 1.586 0 CA-C-O 121.562 0.696 . . . . 0.0 109.315 179.181 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.545 HD23 HG22 ' A' ' 19' ' ' THR . 3.3 pp -104.53 -12.12 16.64 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.529 -0.732 . . . . 0.0 109.902 179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.527 ' CG ' ' O ' ' A' ' 20' ' ' LEU . 3.7 mm-40 -50.58 -30.52 13.41 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.182 -0.948 . . . . 0.0 108.831 179.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -84.87 -23.0 29.16 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.701 -0.851 . . . . 0.0 108.701 178.685 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.455 HD12 ' HA ' ' A' ' 23' ' ' LEU . 76.5 mt -80.97 -27.39 35.99 Favored 'General case' 0 N--CA 1.489 1.504 0 CA-C-O 121.453 0.644 . . . . 0.0 109.446 179.216 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 ttpp -65.35 -48.99 71.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.463 -0.773 . . . . 0.0 109.629 179.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.489 ' O ' ' N ' ' A' ' 32' ' ' ARG . 61.1 m -54.58 -39.62 67.99 Favored 'General case' 0 N--CA 1.486 1.326 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 179.557 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.462 ' O ' ' N ' ' A' ' 33' ' ' HIS . 94.1 mt-10 -64.22 -54.51 32.32 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 178.541 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.64 -45.64 81.48 Favored 'General case' 0 C--N 1.303 -1.443 0 N-CA-C 108.11 -1.07 . . . . 0.0 108.11 178.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 38.7 t -64.19 -28.7 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.133 -1.062 . . . . 0.0 108.133 178.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.489 ' N ' ' O ' ' A' ' 28' ' ' SER . 55.6 mtt180 -79.19 -30.71 43.54 Favored 'General case' 0 N--CA 1.488 1.426 0 O-C-N 121.679 -0.638 . . . . 0.0 109.448 178.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.462 ' N ' ' O ' ' A' ' 29' ' ' GLU . 23.9 m-70 . . . . . 0 N--CA 1.493 1.682 0 CA-C-O 118.146 -0.931 . . . . 0.0 110.231 -179.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.452 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.74 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.548 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 97.5 mt-10 -127.42 50.89 5.84 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.163 -0.96 . . . . 0.0 109.932 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.3 Cg_endo -74.4 -58.73 0.05 OUTLIER 'Trans proline' 0 C--N 1.302 -1.876 0 O-C-N 124.153 1.607 . . . . 0.0 110.091 179.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.52 ' O ' ' CB ' ' A' ' 18' ' ' TRP . 2.2 p90 -44.45 -27.74 0.48 Allowed 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.389 -0.82 . . . . 0.0 110.606 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.521 ' ND2' ' O ' ' A' ' 13' ' ' GLU . 18.4 m120 38.53 71.88 0.15 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.331 -0.855 . . . . 0.0 110.595 -179.649 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.466 ' HB2' ' O ' ' A' ' 16' ' ' ASN . 97.4 mt-10 58.38 19.55 6.51 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.589 -0.695 . . . . 0.0 110.742 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.52 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 11.4 t90 -66.91 -42.41 85.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.102 -0.998 . . . . 0.0 109.88 179.657 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.508 ' O ' ' N ' ' A' ' 22' ' ' LEU . 1.8 m -56.13 -47.24 78.52 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.128 -0.982 . . . . 0.0 110.203 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.485 ' CD1' ' N ' ' A' ' 20' ' ' LEU . 6.1 mp -44.27 -52.29 7.65 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.15 -0.969 . . . . 0.0 109.099 179.545 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -61.65 -30.31 70.64 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.216 -0.927 . . . . 0.0 108.935 178.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.809 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.1 tm? -64.41 -40.77 96.42 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.505 -0.747 . . . . 0.0 109.558 179.497 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.609 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.7 mp -83.34 -26.72 30.29 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.273 -0.892 . . . . 0.0 109.78 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.482 ' HG3' ' O ' ' A' ' 20' ' ' LEU . 73.2 mt-10 -50.13 -23.21 2.01 Favored 'General case' 0 N--CA 1.486 1.366 0 O-C-N 121.159 -0.963 . . . . 0.0 108.465 179.361 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -85.6 -23.02 27.75 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.534 ' N ' ' O ' ' A' ' 23' ' ' LEU . 57.3 mt -82.4 -34.32 28.36 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.401 -0.812 . . . . 0.0 109.02 179.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.442 ' O ' HG23 ' A' ' 31' ' ' VAL . 11.2 ttpp -58.83 -45.69 89.41 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.448 -0.782 . . . . 0.0 109.237 179.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.488 ' O ' ' N ' ' A' ' 32' ' ' ARG . 67.7 m -58.0 -43.25 86.55 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 179.282 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.476 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 76.1 mm-40 -62.06 -51.83 66.4 Favored 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 107.81 -1.182 . . . . 0.0 107.81 178.26 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.99 -48.47 78.35 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 178.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 27' ' ' LYS . 53.2 t -62.38 -26.39 40.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.374 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 178.087 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.488 ' N ' ' O ' ' A' ' 28' ' ' SER . 8.8 mtt-85 -80.35 -26.18 38.82 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 121.495 0.664 . . . . 0.0 109.271 178.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.426 ' N ' ' O ' ' A' ' 29' ' ' GLU . 30.6 m-70 . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.101 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.465 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.733 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.586 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 90.8 mt-10 -121.71 45.92 1.03 Allowed Pre-proline 0 N--CA 1.49 1.574 0 O-C-N 121.142 -0.974 . . . . 0.0 110.659 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.586 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.5 Cg_endo -73.87 -32.18 7.53 Favored 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.84 1.442 . . . . 0.0 110.271 179.818 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.623 ' CD1' ' N ' ' A' ' 16' ' ' ASN . 24.0 p90 -71.09 -32.29 68.87 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.258 -0.901 . . . . 0.0 110.437 -179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.623 ' N ' ' CD1' ' A' ' 15' ' ' TYR . 25.2 m120 -46.99 -52.87 13.69 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.236 -0.915 . . . . 0.0 109.96 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -59.02 -29.33 67.19 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.256 -0.903 . . . . 0.0 109.952 179.605 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.445 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 15.8 t90 -77.45 -37.56 51.27 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 110.333 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -91.24 -45.39 8.65 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.045 -1.034 . . . . 0.0 110.133 -179.729 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.525 HD11 ' HB3' ' A' ' 16' ' ' ASN . 99.5 mt -47.52 -50.71 22.87 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 120.848 -1.158 . . . . 0.0 109.216 179.44 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 24' ' ' GLU . 80.3 tt0 -65.11 -31.35 72.52 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.331 -0.856 . . . . 0.0 109.105 178.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.747 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.7 tm? -55.42 -42.67 74.44 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.358 -0.839 . . . . 0.0 109.35 179.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.66 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.8 mp -82.74 -28.3 30.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.258 -0.901 . . . . 0.0 109.647 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 57.1 mm-40 -49.37 -24.34 1.88 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 179.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -83.24 -25.73 31.4 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 109.004 -0.739 . . . . 0.0 109.004 178.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' A' ' 23' ' ' LEU . 71.1 mt -78.25 -37.94 43.99 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 178.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.443 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.1 ttpm? -58.35 -44.83 88.94 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.997 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.523 ' O ' ' N ' ' A' ' 32' ' ' ARG . 70.9 m -58.22 -42.76 86.94 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 179.494 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.502 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 63.2 tt0 -62.06 -51.62 67.25 Favored 'General case' 0 C--N 1.305 -1.358 0 N-CA-C 107.853 -1.165 . . . . 0.0 107.853 178.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.03 -46.11 82.61 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 178.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.443 HG21 ' HE2' ' A' ' 27' ' ' LYS . 51.6 t -64.33 -28.93 45.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.397 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 178.049 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' A' ' 28' ' ' SER . 53.6 mtt180 -76.6 -32.69 58.24 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-O 121.59 0.709 . . . . 0.0 109.319 178.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.415 ' N ' ' O ' ' A' ' 29' ' ' GLU . 31.9 m-70 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.149 -179.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.442 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.214 -0.768 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.588 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 94.1 mt-10 52.08 44.59 2.15 Favored Pre-proline 0 N--CA 1.489 1.484 0 O-C-N 121.453 -0.78 . . . . 0.0 110.507 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.588 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 50.3 Cg_endo -75.2 -27.57 9.58 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 O-C-N 123.606 1.319 . . . . 0.0 109.104 179.478 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.588 ' CE2' ' ND2' ' A' ' 16' ' ' ASN . 53.1 p90 -72.45 -29.8 64.01 Favored 'General case' 0 N--CA 1.487 1.396 0 O-C-N 121.631 -0.668 . . . . 0.0 109.966 179.516 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.749 ' O ' HD22 ' A' ' 20' ' ' LEU . 29.8 m120 -61.68 -19.25 62.14 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.405 -0.81 . . . . 0.0 110.502 179.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -75.56 -39.51 58.11 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.204 -0.935 . . . . 0.0 110.818 -179.332 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.555 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 64.0 p-90 -116.14 -35.96 4.22 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.97 -1.082 . . . . 0.0 111.031 -179.764 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.493 ' CB ' ' O ' ' A' ' 15' ' ' TYR . 70.9 m -49.57 -49.62 45.73 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.065 -1.022 . . . . 0.0 110.042 -179.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.749 HD22 ' O ' ' A' ' 16' ' ' ASN . 4.2 mp -47.55 -54.38 11.85 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.106 -0.996 . . . . 0.0 109.287 179.452 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -70.75 -20.68 62.61 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.176 -0.952 . . . . 0.0 109.178 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.758 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.3 tm? -68.01 -33.86 75.42 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.435 -0.791 . . . . 0.0 109.476 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.973 HD23 HD12 ' A' ' 26' ' ' LEU . 94.3 mt -99.05 -19.15 17.39 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.326 -0.859 . . . . 0.0 109.655 179.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 18.6 mm-40 -49.11 -26.9 3.02 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.297 -0.877 . . . . 0.0 108.895 179.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 19.8 pt-20 -84.05 -25.85 29.52 Favored 'General case' 0 N--CA 1.488 1.471 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.973 HD12 HD23 ' A' ' 23' ' ' LEU . 66.8 mt -81.87 -29.52 32.44 Favored 'General case' 0 N--CA 1.487 1.384 0 O-C-N 121.466 -0.771 . . . . 0.0 109.039 178.852 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.431 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.2 ttpm? -63.32 -48.0 79.88 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.409 -0.807 . . . . 0.0 109.365 179.242 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.468 ' O ' ' N ' ' A' ' 32' ' ' ARG . 33.0 t -55.36 -37.79 67.97 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 179.283 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.455 ' O ' ' HB2' ' A' ' 32' ' ' ARG . 91.9 mt-10 -65.2 -56.39 13.1 Favored 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 108.032 -1.099 . . . . 0.0 108.032 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.91 -45.11 78.78 Favored 'General case' 0 C--N 1.305 -1.363 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.431 HG21 ' HE2' ' A' ' 27' ' ' LYS . 55.7 t -64.79 -27.46 42.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 178.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.468 ' N ' ' O ' ' A' ' 28' ' ' SER . 10.2 mtp180 -79.12 -29.32 43.13 Favored 'General case' 0 C--N 1.305 -1.358 0 CA-C-O 121.587 0.708 . . . . 0.0 109.199 178.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.416 ' N ' ' O ' ' A' ' 29' ' ' GLU . 28.2 m-70 . . . . . 0 N--CA 1.49 1.527 0 CA-C-O 117.927 -1.035 . . . . 0.0 110.233 -179.357 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.456 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.718 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.581 ' HA ' ' CE2' ' A' ' 15' ' ' TYR . 73.8 mt-10 -123.14 51.67 3.9 Favored Pre-proline 0 N--CA 1.49 1.533 0 O-C-N 121.241 -0.912 . . . . 0.0 109.995 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.525 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 48.6 Cg_endo -71.9 -31.71 12.29 Favored 'Trans proline' 0 C--N 1.305 -1.759 0 O-C-N 124.164 1.612 . . . . 0.0 110.773 -179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.638 ' CE1' ' ND2' ' A' ' 16' ' ' ASN . 31.3 p90 -59.56 -24.11 63.45 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.3 -0.875 . . . . 0.0 110.948 -179.396 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.638 ' ND2' ' CE1' ' A' ' 15' ' ' TYR . 13.4 m120 -39.97 -56.14 1.89 Allowed 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.287 -0.883 . . . . 0.0 110.445 -179.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 98.8 mt-10 -61.31 -26.96 68.14 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.302 -0.873 . . . . 0.0 110.729 -179.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.471 ' C ' ' CE3' ' A' ' 18' ' ' TRP . 12.3 t90 -76.23 -39.59 54.16 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.085 -1.01 . . . . 0.0 110.197 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.51 ' O ' ' N ' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -93.77 -45.73 7.54 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.102 -0.999 . . . . 0.0 110.066 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.52 ' CD1' ' HB3' ' A' ' 16' ' ' ASN . 61.0 mt -45.61 -49.6 14.04 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 120.967 -1.083 . . . . 0.0 109.243 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.513 ' HA ' ' CG ' ' A' ' 24' ' ' GLU . 42.8 tt0 -66.55 -23.66 66.25 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.0 109.129 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.944 HD13 ' O ' ' A' ' 22' ' ' LEU . 2.8 tm? -67.51 -30.66 70.4 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.054 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.517 ' N ' HD12 ' A' ' 23' ' ' LEU . 6.2 mp -95.58 -19.29 19.9 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.656 -0.653 . . . . 0.0 109.442 179.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.513 ' CG ' ' HA ' ' A' ' 21' ' ' GLU . 35.6 mt-10 -48.54 -29.1 3.87 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.349 -0.844 . . . . 0.0 108.804 179.491 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -85.19 -24.7 27.79 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 178.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.515 HD12 ' HG ' ' A' ' 23' ' ' LEU . 42.4 mt -75.84 -31.36 59.3 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.34 -0.85 . . . . 0.0 108.909 178.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.48 ' HE2' HG21 ' A' ' 31' ' ' VAL . 2.4 ttpm? -61.72 -48.73 79.41 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.455 -0.778 . . . . 0.0 109.08 179.112 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.511 ' O ' ' CG ' ' A' ' 32' ' ' ARG . 65.8 m -53.39 -35.02 59.9 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.139 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.489 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 49.9 tt0 -65.71 -55.14 18.97 Favored 'General case' 0 C--N 1.304 -1.373 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 178.552 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.89 -45.74 85.95 Favored 'General case' 0 C--N 1.303 -1.423 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.332 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.48 HG21 ' HE2' ' A' ' 27' ' ' LYS . 41.9 t -64.71 -26.27 39.78 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.511 ' CG ' ' O ' ' A' ' 28' ' ' SER . 63.4 mtt180 -80.55 -30.37 37.09 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 108.955 -0.757 . . . . 0.0 108.955 178.708 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . 0.442 ' N ' ' O ' ' A' ' 29' ' ' GLU . 23.7 m-70 . . . . . 0 N--CA 1.489 1.513 0 CA-C-O 117.987 -1.006 . . . . 0.0 109.994 -179.488 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.451 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.216 -0.662 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.59 ' HA ' ' CE2' ' A' ' 15' ' ' TYR . 97.1 mt-10 -123.05 51.61 3.78 Favored Pre-proline 0 N--CA 1.491 1.606 0 O-C-N 121.262 -0.899 . . . . 0.0 110.117 . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.512 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 46.1 Cg_endo -72.29 -28.11 15.63 Favored 'Trans proline' 0 C--N 1.304 -1.766 0 O-C-N 123.941 1.495 . . . . 0.0 110.402 180.0 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.59 ' CE2' ' HA ' ' A' ' 13' ' ' GLU . 51.6 p90 -65.99 -31.42 72.31 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.256 -0.903 . . . . 0.0 110.518 -179.832 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.892 ' O ' HD22 ' A' ' 20' ' ' LEU . 44.9 m-20 -62.35 -16.94 57.48 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.254 -0.903 . . . . 0.0 110.306 -179.888 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 61.1 tt0 -76.3 -38.91 55.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.302 -0.874 . . . . 0.0 110.666 -179.533 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.58 ' CE2' ' HA ' ' A' ' 15' ' ' TYR . 63.1 p-90 -117.11 -39.45 3.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 120.957 -1.089 . . . . 0.0 110.534 -179.95 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.531 ' HA ' ' HB3' ' A' ' 22' ' ' LEU . 42.4 m -49.98 -44.24 50.82 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.085 -1.009 . . . . 0.0 110.063 -179.756 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.892 HD22 ' O ' ' A' ' 16' ' ' ASN . 3.8 mp -47.18 -54.03 11.66 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 120.87 -1.144 . . . . 0.0 109.237 179.359 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 21' ' ' GLU . 37.4 tt0 -71.65 -14.61 62.1 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.262 -0.898 . . . . 0.0 109.291 178.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.807 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.5 tm? -78.79 -30.63 45.59 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.559 -0.713 . . . . 0.0 109.237 179.143 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.988 HD23 HD12 ' A' ' 26' ' ' LEU . 89.2 mt -101.51 -17.35 16.46 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.552 -0.717 . . . . 0.0 109.51 179.387 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 20' ' ' LEU . 12.5 mm-40 -48.41 -27.51 2.67 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.251 -0.906 . . . . 0.0 108.726 179.25 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 23.0 pt-20 -84.41 -27.16 27.8 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 178.872 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.988 HD12 HD23 ' A' ' 23' ' ' LEU . 16.9 mt -78.91 -28.01 43.87 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.479 -0.763 . . . . 0.0 109.08 178.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.657 ' O ' HG23 ' A' ' 31' ' ' VAL . 8.7 ttpp -61.46 -43.95 97.96 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.453 -0.779 . . . . 0.0 109.465 179.51 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.512 ' O ' ' N ' ' A' ' 32' ' ' ARG . 60.6 m -57.61 -41.57 81.51 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 179.678 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.491 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 76.9 tt0 -63.38 -51.91 63.88 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.126 -1.065 . . . . 0.0 108.126 178.569 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.31 -47.33 81.78 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 107.913 -1.144 . . . . 0.0 107.913 178.176 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 27' ' ' LYS . 97.7 t -62.77 -30.31 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 178.043 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' A' ' 28' ' ' SER . 60.1 mtt180 -74.91 -27.7 60.32 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 121.566 0.698 . . . . 0.0 109.4 179.114 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.0 m-70 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 118.101 -0.952 . . . . 0.0 110.077 -179.352 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ACE . . . . . 0.455 ' C ' ' HD3' ' A' ' 14' ' ' PRO . . . . . . . . 0 C--O 1.215 -0.714 . . . . . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.564 ' N ' ' CD ' ' A' ' 14' ' ' PRO . 50.4 mt-10 -122.56 48.59 1.89 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.305 -0.872 . . . . 0.0 110.238 . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 13' ' ' GLU . 47.5 Cg_endo -71.95 -13.05 28.92 Favored 'Trans proline' 0 C--N 1.305 -1.749 0 O-C-N 124.051 1.553 . . . . 0.0 110.697 -179.898 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.539 ' O ' ' C ' ' A' ' 16' ' ' ASN . 29.0 p90 -88.34 -1.24 57.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.256 -0.902 . . . . 0.0 110.714 -179.539 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ASN . . . . . 0.539 ' C ' ' O ' ' A' ' 15' ' ' TYR . 12.5 m120 -22.16 -53.67 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 CA-C-O 121.129 0.49 . . . . 0.0 111.78 -179.284 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.406 ' N ' ' O ' ' A' ' 15' ' ' TYR . 86.5 mt-10 -113.27 -10.29 13.34 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.118 -0.989 . . . . 0.0 110.429 -179.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.502 ' HB3' ' HA ' ' A' ' 15' ' ' TYR . 62.8 t90 -61.1 -51.87 67.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.104 -0.997 . . . . 0.0 110.109 179.947 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.429 ' O ' ' HB3' ' A' ' 22' ' ' LEU . 0.2 OUTLIER -72.74 -37.85 67.58 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.314 -0.866 . . . . 0.0 109.999 -179.889 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.518 ' CD1' ' O ' ' A' ' 16' ' ' ASN . 41.9 mt -52.38 -40.34 61.94 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.37 -0.831 . . . . 0.0 109.674 179.72 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.468 ' HA ' ' HG3' ' A' ' 24' ' ' GLU . 75.3 tt0 -80.48 -17.63 51.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.23 -0.919 . . . . 0.0 109.319 179.209 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.877 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.0 tm? -68.63 -36.15 78.24 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.563 -0.711 . . . . 0.0 109.828 179.809 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.616 ' HA ' HD12 ' A' ' 26' ' ' LEU . 6.1 mp -87.86 -13.42 42.12 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.258 -0.901 . . . . 0.0 110.208 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.468 ' HG3' ' HA ' ' A' ' 21' ' ' GLU . 74.8 mt-10 -50.5 -27.64 6.97 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.086 -1.009 . . . . 0.0 109.135 179.915 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.423 ' HG2' ' O ' ' A' ' 22' ' ' LEU . 14.3 pt-20 -82.55 -22.7 34.85 Favored 'General case' 0 N--CA 1.488 1.463 0 N-CA-C 108.601 -0.889 . . . . 0.0 108.601 178.695 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.616 HD12 ' HA ' ' A' ' 23' ' ' LEU . 84.1 mt -79.33 -32.2 43.27 Favored 'General case' 0 N--CA 1.489 1.5 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 179.114 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.64 ' HE2' HG21 ' A' ' 31' ' ' VAL . 1.8 ttpm? -62.23 -41.79 98.73 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.48 -0.762 . . . . 0.0 109.705 179.548 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.509 ' O ' ' N ' ' A' ' 32' ' ' ARG . 57.0 m -53.53 -39.85 65.01 Favored 'General case' 0 N--CA 1.486 1.373 0 O-C-N 121.371 -0.83 . . . . 0.0 108.907 179.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.468 ' HA ' ' HB2' ' A' ' 32' ' ' ARG . 8.5 tp10 -61.61 -51.85 66.81 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 178.581 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.87 -47.26 80.85 Favored 'General case' 0 C--N 1.303 -1.413 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 178.194 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 27' ' ' LYS . 78.4 t -63.94 -26.97 41.82 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.208 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' A' ' 28' ' ' SER . 40.2 mtt180 -78.44 -29.76 47.2 Favored 'General case' 0 N--CA 1.488 1.434 0 CA-C-O 121.602 0.715 . . . . 0.0 109.389 178.876 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 36.8 m-70 . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.008 -0.996 . . . . 0.0 110.22 -179.338 . . . . . . . . 0 0 . 1 stop_ save_