data_1umq_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 1umq _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 81.9 t . . . . . 0 C--O 1.236 0.373 0 CA-C-O 120.716 0.293 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.685 ' O ' HG13 ' A' ' 46' ' ' ILE . 52.1 mtm180 -67.06 -49.47 65.02 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.528 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.616 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -58.75 -38.13 77.75 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.428 0.632 . . . . 0.0 109.834 -178.758 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.16 -30.89 71.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.716 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.737 ' O ' HG21 ' A' ' 49' ' ' ILE . 6.2 t60 -81.96 -32.0 30.95 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.685 HG13 ' O ' ' A' ' 42' ' ' ARG . 11.7 mt -60.14 -37.36 72.84 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.354 177.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -74.22 -49.06 24.97 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.853 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.08 -29.45 69.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.653 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.94 HG22 HG22 ' A' ' 60' ' ' THR . 2.9 tp -85.25 -42.22 16.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.854 176.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.456 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 17.0 t80 -57.63 -31.71 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.09 0.472 . . . . 0.0 110.415 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -72.04 -48.66 42.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.39 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.529 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 24.5 ptm -74.2 -31.37 62.61 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -171.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 28.1 p -89.7 0.9 56.68 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.066 -0.396 . . . . 0.0 110.647 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.1 t70 56.3 62.1 2.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.003 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 69.9 20.52 6.63 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.055 172.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.463 ' HB3' ' HB2' ' A' ' 53' ' ' CYS . 49.7 t-20 -78.12 100.56 6.62 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 174.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.445 HG11 HD11 ' A' ' 71' ' ' LEU . 47.4 t -65.49 -28.86 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.313 -176.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.0 m -68.58 -48.1 65.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.824 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.55 ' HG3' HD12 ' A' ' 49' ' ' ILE . 10.2 tp10 -62.3 -42.26 99.21 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 109.82 177.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.94 HG22 HG22 ' A' ' 49' ' ' ILE . 27.9 m -59.08 -54.26 49.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.977 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.623 ' HA ' ' SD ' ' A' ' 66' ' ' MET . . . -61.32 -35.32 77.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.834 0.35 . . . . 0.0 111.667 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -74.99 -31.32 61.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.444 0.64 . . . . 0.0 109.763 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.583 ' HD3' HD11 ' A' ' 49' ' ' ILE . 46.2 ttt85 -83.28 -16.37 46.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.139 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.69 HD12 ' HB3' ' A' ' 45' ' ' HIS . 4.1 mm? -95.35 -10.4 30.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.011 175.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 62.94 69.65 0.58 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.055 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.978 ' HG3' ' HB ' ' A' ' 70' ' ' THR . 0.1 OUTLIER -160.32 174.33 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.198 -177.507 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.57 152.58 25.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.567 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.455 ' O ' ' HD2' ' A' ' 68' ' ' ARG . 2.9 tmm_? -56.4 -37.77 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.112 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 mmt180 -61.4 -37.58 83.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.167 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.978 ' HB ' ' HG3' ' A' ' 66' ' ' MET . 5.4 m -59.87 -52.44 65.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.629 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.938 HD22 HG21 ' A' ' 60' ' ' THR . 0.3 OUTLIER -59.45 -45.12 92.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.588 178.418 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -59.77 -50.01 75.48 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.386 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -61.86 -38.51 88.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.7 0.286 . . . . 0.0 110.612 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.619 HG23 ' CD1' ' A' ' 46' ' ' ILE . 91.3 mt -62.06 -41.58 91.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.647 177.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 43.8 mt -70.11 -40.68 74.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.682 0.754 . . . . 0.0 110.169 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.705 -170.276 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 121.658 0.742 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.658 ' O ' HG13 ' A' ' 46' ' ' ILE . 50.4 ttp180 -76.68 -47.82 20.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.99 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.631 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -58.45 -42.17 86.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.652 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -60.11 -24.54 64.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.706 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.614 ' O ' HG21 ' A' ' 49' ' ' ILE . 4.8 t60 -82.58 -39.64 21.98 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.698 HG12 ' HG ' ' A' ' 64' ' ' LEU . 9.6 mt -62.58 -27.76 43.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.016 177.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.41 -48.23 35.57 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.594 -174.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.564 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -71.63 -32.77 68.33 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.675 -173.177 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.887 HG22 HG21 ' A' ' 60' ' ' THR . 4.9 tp -82.99 -30.91 8.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.543 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.472 ' CE1' HD23 ' A' ' 75' ' ' LEU . 22.8 t80 -55.11 -40.07 70.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.362 0.601 . . . . 0.0 109.581 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.62 -30.69 61.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.123 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.62 ' HB2' HD13 ' A' ' 49' ' ' ILE . 92.8 mmm -58.44 -56.61 19.91 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.135 0.493 . . . . 0.0 111.48 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 40.7 t -97.86 3.06 49.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.946 -172.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.1 t70 67.05 80.76 0.21 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.74 -178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.445 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 47.2 mtp180 63.74 13.99 7.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 167.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -83.21 112.25 19.69 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.208 0.527 . . . . 0.0 110.79 176.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.93 -35.59 75.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.779 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 m -60.0 -50.24 74.51 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.186 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.612 ' HG3' HD12 ' A' ' 49' ' ' ILE . 8.4 tp10 -69.08 -37.72 78.62 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -178.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.887 HG21 HG22 ' A' ' 49' ' ' ILE . 38.3 m -54.5 -56.44 18.77 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.649 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.67 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . . . -56.5 -33.94 66.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.62 -177.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -66.24 -30.24 70.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.229 0.538 . . . . 0.0 110.749 178.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.667 ' HB3' HD11 ' A' ' 64' ' ' LEU . 1.2 tpt180 -73.34 -53.08 11.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.018 -178.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.698 ' HG ' HG12 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -88.14 12.11 14.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.703 -175.371 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 t30 59.03 37.69 24.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 110.739 173.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.698 ' HB2' HD22 ' A' ' 64' ' ' LEU . 8.7 mtp -112.73 165.54 12.19 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.713 -175.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.406 ' HB3' ' OG1' ' A' ' 70' ' ' THR . 28.9 t60 -82.64 153.61 25.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.497 -1.229 . . . . 0.0 108.691 177.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -55.95 -47.43 77.58 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.608 0.242 . . . . 0.0 111.329 -175.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -64.15 -31.65 72.93 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.472 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.472 HG23 ' HE1' ' A' ' 66' ' ' MET . 6.6 m -60.26 -49.78 76.25 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.234 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.787 HD22 HG23 ' A' ' 60' ' ' THR . 0.3 OUTLIER -60.08 -46.44 89.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.378 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -58.17 -48.87 78.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.386 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -63.37 -50.06 71.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.04 0.447 . . . . 0.0 110.617 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.437 HG22 ' CD1' ' A' ' 46' ' ' ILE . 64.9 mt -58.92 -50.09 80.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.942 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.478 ' HA ' ' HH2' ' A' ' 43' ' ' TRP . 15.4 tp -61.87 -38.64 89.03 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.957 -178.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.903 -175.31 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.4 t . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.802 0.334 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.667 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.7 mtm180 -67.27 -48.47 67.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.314 176.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.55 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -55.85 -41.26 74.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.172 -177.64 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.57 -37.68 70.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.697 177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.727 ' O ' HG21 ' A' ' 49' ' ' ILE . 3.0 t60 -77.26 -35.86 54.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.713 ' CD1' HG23 ' A' ' 74' ' ' ILE . 14.7 mt -63.26 -36.02 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.695 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -72.5 -49.74 30.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.01 -175.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.93 -28.63 69.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.47 -176.679 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 1.013 HG22 HG22 ' A' ' 60' ' ' THR . 3.4 tp -86.14 -41.98 15.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.192 177.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.437 ' CE2' ' HA ' ' A' ' 55' ' ' ARG . 23.5 t80 -58.89 -32.8 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 0.0 110.379 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -72.83 -43.64 62.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.306 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.56 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 25.5 ptm -76.01 -41.23 51.67 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -173.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.474 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 28.6 p -81.43 -3.25 52.37 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.908 0.385 . . . . 0.0 110.679 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.2 t70 60.48 76.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.572 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.437 ' HA ' ' CE2' ' A' ' 50' ' ' TYR . 64.6 mtt180 64.76 15.97 10.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.538 170.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.474 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 53.4 t-20 -85.41 97.52 10.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.022 0.439 . . . . 0.0 109.965 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.402 HG22 HD13 ' A' ' 71' ' ' LEU . 9.4 p -62.54 -29.7 47.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.309 -177.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.7 m -65.73 -48.93 70.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.319 -176.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.778 ' HG2' HD12 ' A' ' 49' ' ' ILE . 20.7 tt0 -74.68 -35.81 62.78 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.73 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 1.013 HG22 HG22 ' A' ' 49' ' ' ILE . 33.4 m -52.86 -42.03 64.85 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.46 -52.56 64.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.679 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -60.19 -41.5 93.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.462 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.614 ' HD3' HD11 ' A' ' 49' ' ' ILE . 0.7 OUTLIER -72.8 -18.62 61.46 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.394 -178.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.537 HD22 ' O ' ' A' ' 60' ' ' THR . 2.8 mm? -93.21 -2.42 55.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.176 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.4 m120 63.68 26.54 14.58 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.687 0.756 . . . . 0.0 109.422 -176.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.459 ' HE1' HG21 ' A' ' 70' ' ' THR . 10.9 mtp -120.5 157.47 29.35 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.548 -172.083 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -74.67 154.24 38.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.077 174.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . 0.409 ' O ' ' HD2' ' A' ' 68' ' ' ARG . 2.6 tmm_? -55.2 -42.12 72.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.218 -175.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -67.81 -33.83 75.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.304 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.459 HG21 ' HE1' ' A' ' 66' ' ' MET . 6.7 m -59.68 -49.46 77.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.1 0.476 . . . . 0.0 110.132 177.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.811 HD22 HG21 ' A' ' 60' ' ' THR . 0.3 OUTLIER -61.57 -43.92 97.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.832 178.562 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -64.07 -46.51 83.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.41 -176.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -62.03 -35.18 77.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.995 0.426 . . . . 0.0 110.218 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.713 HG23 ' CD1' ' A' ' 46' ' ' ILE . 78.2 mt -68.95 -47.46 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.999 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 92.9 mt -58.32 -43.56 88.23 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.594 0.712 . . . . 0.0 109.778 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.74 -174.019 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 76.6 t . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.724 0.297 . . . . 0.0 110.67 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.724 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.3 mtm180 -64.09 -49.23 73.04 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.643 178.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.592 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.8 -41.75 98.14 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.129 0.49 . . . . 0.0 110.082 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -57.29 -35.53 69.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.259 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.627 ' O ' HG21 ' A' ' 49' ' ' ILE . 3.7 t60 -75.31 -37.16 60.94 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.789 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 42' ' ' ARG . 12.5 mt -62.76 -36.59 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.16 0.505 . . . . 0.0 110.266 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -72.05 -49.21 38.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.756 -176.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -30.26 69.85 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.736 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.985 HG22 HG22 ' A' ' 60' ' ' THR . 3.1 tp -86.28 -43.15 16.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.702 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -57.21 -39.85 76.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.533 -176.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.6 -39.47 67.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.789 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.589 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 15.2 ptp -76.82 -31.28 56.81 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.911 -174.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.541 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 9.7 t -92.77 10.88 28.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.949 0.404 . . . . 0.0 110.605 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.3 t70 58.04 65.64 1.26 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 82.2 mtt180 59.41 23.15 11.67 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.309 172.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.541 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 48.8 t30 -91.82 111.45 22.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.233 0.54 . . . . 0.0 110.343 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -71.82 -27.34 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.898 -172.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 53.7 p -63.05 -50.27 71.27 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.146 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.546 ' HG3' HD12 ' A' ' 49' ' ' ILE . 13.2 tp10 -69.75 -37.67 76.52 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.074 177.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.985 HG22 HG22 ' A' ' 49' ' ' ILE . 32.5 m -55.43 -51.91 65.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.815 0.341 . . . . 0.0 110.219 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.43 -44.14 97.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.229 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -41.3 95.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.112 0.482 . . . . 0.0 109.949 -177.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.604 ' HD3' HD11 ' A' ' 49' ' ' ILE . 40.9 ttt85 -79.81 -13.08 59.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.079 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.514 HD22 ' O ' ' A' ' 60' ' ' THR . 3.0 mm? -89.57 -6.59 56.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.53 170.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.8 t30 59.89 36.43 21.83 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 122.12 0.962 . . . . 0.0 108.901 -178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.724 ' SD ' ' HB ' ' A' ' 70' ' ' THR . 2.6 tmm? -140.37 157.84 44.93 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.392 -165.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . 0.486 ' N ' ' HG2' ' A' ' 66' ' ' MET . 0.0 OUTLIER -81.76 149.8 28.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.438 -177.788 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -24.2 67.48 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -176.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -60.63 -29.41 69.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.333 0.587 . . . . 0.0 110.111 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.724 ' HB ' ' SD ' ' A' ' 66' ' ' MET . 8.7 m -83.9 -53.09 5.84 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.173 -0.922 . . . . 0.0 110.314 176.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.83 HD22 HG21 ' A' ' 60' ' ' THR . 0.2 OUTLIER -54.61 -52.06 63.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.927 0.491 . . . . 0.0 110.879 -178.376 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.85 -46.38 89.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.592 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -65.05 -32.16 73.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.915 0.388 . . . . 0.0 111.105 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.603 HG23 ' CD1' ' A' ' 46' ' ' ILE . 82.8 mt -67.28 -46.87 82.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.694 175.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 53.1 mt -65.19 -46.87 79.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.445 0.64 . . . . 0.0 110.245 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.118 -174.25 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 76.1 t . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.879 0.371 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.731 ' O ' HG13 ' A' ' 46' ' ' ILE . 24.6 mtm180 -64.35 -49.21 72.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.442 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.564 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.64 -37.06 82.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.029 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -59.68 -34.64 73.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' HIS . . . . . 0.606 ' O ' HG21 ' A' ' 49' ' ' ILE . 5.1 t60 -79.99 -31.99 39.78 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.775 ' CD1' HG23 ' A' ' 74' ' ' ILE . 24.1 mt -69.09 -35.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.766 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 83.5 mm-40 -73.1 -48.8 32.64 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.021 0.439 . . . . 0.0 109.896 -177.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.657 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -59.81 -30.69 69.09 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.447 -178.451 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ILE . . . . . 0.851 HG22 HG22 ' A' ' 60' ' ' THR . 4.1 tp -86.07 -35.81 9.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.088 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.589 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 2.2 t80 -59.86 -36.41 76.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.233 0.54 . . . . 0.0 109.716 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 47' ' ' GLN . 45.4 mt-10 -73.51 -34.04 65.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.465 175.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' MET . . . . . 0.657 ' HG2' ' O ' ' A' ' 48' ' ' ARG . 74.0 mmm -59.36 -61.26 2.76 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.068 0.461 . . . . 0.0 112.23 -176.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.592 ' HB3' ' HB3' ' A' ' 56' ' ' ASN . 6.2 t -103.36 21.24 16.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.821 -170.139 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.8 t0 56.95 72.34 0.52 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.858 175.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.57 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 78.6 mtt180 62.15 21.4 12.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.906 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . 0.592 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 41.0 t-20 -76.07 95.52 3.64 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 175.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.75 -34.17 61.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.097 -177.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 m -59.04 -51.54 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.573 ' OE1' ' HD2' ' A' ' 62' ' ' ARG . 6.0 tp10 -67.02 -38.68 86.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' THR . . . . . 0.856 HG21 HD22 ' A' ' 71' ' ' LEU . 30.4 m -57.39 -56.0 27.49 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.81 -178.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.465 ' HA ' HD21 ' A' ' 71' ' ' LEU . . . -55.81 -42.68 76.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.598 0.237 . . . . 0.0 110.913 178.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.573 ' HD2' ' OE1' ' A' ' 59' ' ' GLU . 0.3 OUTLIER -66.91 -44.63 80.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.105 0.479 . . . . 0.0 110.566 -177.466 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.595 ' HD3' HD11 ' A' ' 49' ' ' ILE . 12.8 ttt180 -75.38 -20.07 59.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.698 -177.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' LEU . . . . . 0.738 ' HB3' ' SD ' ' A' ' 66' ' ' MET . 3.1 mm? -86.18 -11.52 52.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.711 174.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.4 m120 69.66 31.64 3.55 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.102 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' MET . . . . . 0.738 ' SD ' ' HB3' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -127.24 168.4 14.78 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.863 0.839 . . . . 0.0 112.123 178.761 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -80.69 161.68 24.51 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.127 -1.397 . . . . 0.0 109.566 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 19.1 tpp85 -52.02 -51.79 55.03 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.924 0.392 . . . . 0.0 111.761 -178.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -64.11 -28.52 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.925 -176.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' THR . . . . . 0.503 HG21 ' HE1' ' A' ' 66' ' ' MET . 3.9 m -62.36 -58.6 7.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.402 176.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.856 HD22 HG21 ' A' ' 60' ' ' THR . 0.2 OUTLIER -55.96 -46.23 78.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.318 -179.234 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -56.74 -46.4 81.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.319 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.4 mtm180 -69.97 -29.42 66.52 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.775 HG23 ' CD1' ' A' ' 46' ' ' ILE . 1.4 mp -71.79 -43.66 69.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.132 174.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 78.0 mt -60.8 -46.3 91.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.483 0.659 . . . . 0.0 109.439 175.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.287 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.624 -175.668 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.503 HD13 ' O ' ' A' ' 22' ' ' LEU . 3.1 pp . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 120.589 0.233 . . . . 0.0 110.632 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 61.69 177.7 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.997 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -136.38 -162.91 1.33 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.184 176.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 73.68 -107.74 2.32 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.974 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -96.12 -7.11 36.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.9 0.381 . . . . 0.0 110.762 -176.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.5 m -80.89 -15.0 57.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.865 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.41 ' HA ' ' HD2' ' A' ' 29' ' ' PRO . 3.2 tt -132.22 95.75 20.84 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.41 ' HD2' ' HA ' ' A' ' 28' ' ' LEU . 40.9 Cg_exo -32.32 119.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 125.119 3.879 . . . . 0.0 114.82 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 1.7 Cg_endo -85.08 132.02 4.45 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.406 2.737 . . . . 0.0 111.664 174.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.437 ' HD3' ' HA ' ' A' ' 30' ' ' PRO . 18.7 Cg_exo -67.5 172.87 9.67 Favored 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.951 2.434 . . . . 0.0 111.562 176.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -70.89 55.06 1.7 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.812 2.342 . . . . 0.0 112.268 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -62.75 -35.3 79.33 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.202 -177.747 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -87.17 134.3 36.93 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.717 -176.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_endo -48.68 -48.09 18.75 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.545 2.83 . . . . 0.0 112.198 174.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 67.0 mtt -86.91 74.4 9.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.601 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.631 ' HB3' ' HB2' ' A' ' 40' ' ' ARG . 25.0 t -73.03 161.94 30.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.581 176.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.8 96.92 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.073 0.463 . . . . 0.0 110.603 -172.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -87.49 -26.79 23.02 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.276 -0.569 . . . . 0.0 109.982 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.631 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 3.7 tmt_? -59.88 -44.08 94.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.737 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.439 HG21 ' O ' ' A' ' 37' ' ' SER . 81.9 t -60.64 -35.89 66.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.528 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.685 ' O ' HG13 ' A' ' 46' ' ' ILE . 52.1 mtm180 -67.06 -49.47 65.02 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.528 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.655 ' HZ2' ' HG2' ' A' ' 78' ' ' ARG . 0.0 OUTLIER -58.75 -38.13 77.75 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.428 0.632 . . . . 0.0 109.834 -178.758 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.16 -30.89 71.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.716 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.737 ' O ' HG21 ' A' ' 49' ' ' ILE . 6.2 t60 -81.96 -32.0 30.95 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.685 HG13 ' O ' ' A' ' 42' ' ' ARG . 11.7 mt -60.14 -37.36 72.84 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.354 177.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -74.22 -49.06 24.97 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.853 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.08 -29.45 69.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.653 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.94 HG22 HG22 ' A' ' 60' ' ' THR . 2.9 tp -85.25 -42.22 16.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.854 176.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.456 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 17.0 t80 -57.63 -31.71 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.09 0.472 . . . . 0.0 110.415 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -72.04 -48.66 42.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.39 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.529 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 24.5 ptm -74.2 -31.37 62.61 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -171.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 28.1 p -89.7 0.9 56.68 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.066 -0.396 . . . . 0.0 110.647 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.1 t70 56.3 62.1 2.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.003 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 69.9 20.52 6.63 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.055 172.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.463 ' HB3' ' HB2' ' A' ' 53' ' ' CYS . 49.7 t-20 -78.12 100.56 6.62 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 174.254 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.445 HG11 HD11 ' A' ' 71' ' ' LEU . 47.4 t -65.49 -28.86 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.313 -176.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.0 m -68.58 -48.1 65.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.824 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.55 ' HG3' HD12 ' A' ' 49' ' ' ILE . 10.2 tp10 -62.3 -42.26 99.21 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 109.82 177.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.94 HG22 HG22 ' A' ' 49' ' ' ILE . 27.9 m -59.08 -54.26 49.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.977 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.623 ' HA ' ' SD ' ' A' ' 66' ' ' MET . . . -61.32 -35.32 77.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.834 0.35 . . . . 0.0 111.667 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -74.99 -31.32 61.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.444 0.64 . . . . 0.0 109.763 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.583 ' HD3' HD11 ' A' ' 49' ' ' ILE . 46.2 ttt85 -83.28 -16.37 46.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.139 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.69 HD12 ' HB3' ' A' ' 45' ' ' HIS . 4.1 mm? -95.35 -10.4 30.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.011 175.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 62.94 69.65 0.58 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.055 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.978 ' HG3' ' HB ' ' A' ' 70' ' ' THR . 0.1 OUTLIER -160.32 174.33 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.198 -177.507 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.57 152.58 25.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.567 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.455 ' O ' ' HD2' ' A' ' 68' ' ' ARG . 2.9 tmm_? -56.4 -37.77 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.112 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 mmt180 -61.4 -37.58 83.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.167 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.978 ' HB ' ' HG3' ' A' ' 66' ' ' MET . 5.4 m -59.87 -52.44 65.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.629 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.938 HD22 HG21 ' A' ' 60' ' ' THR . 0.3 OUTLIER -59.45 -45.12 92.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.588 178.418 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -59.77 -50.01 75.48 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.386 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -61.86 -38.51 88.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.7 0.286 . . . . 0.0 110.612 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.619 HG23 ' CD1' ' A' ' 46' ' ' ILE . 91.3 mt -62.06 -41.58 91.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.647 177.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.56 ' HB3' HH21 ' A' ' 81' ' ' ARG . 43.8 mt -70.11 -40.68 74.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.682 0.754 . . . . 0.0 110.169 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.03 -22.39 59.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.705 -170.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -13.08 58.1 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.792 176.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.655 ' HG2' ' HZ2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -113.2 4.05 16.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.022 0.439 . . . . 0.0 111.106 -179.177 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.406 ' C ' ' H ' ' A' ' 81' ' ' ARG . 46.1 m -149.26 154.65 39.16 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.177 178.489 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -77.8 29.82 0.44 Allowed 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 122.767 2.311 . . . . 0.0 112.317 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.56 HH21 ' HB3' ' A' ' 75' ' ' LEU . 56.2 ttp180 . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.376 -176.249 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.801 HD12 ' HA ' ' A' ' 28' ' ' LEU . 2.4 pt? . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.91 141.26 58.83 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.991 0.424 . . . . 0.0 111.245 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -85.79 133.67 33.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.457 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.43 -3.53 77.53 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.345 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -102.05 26.23 7.86 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.854 0.359 . . . . 0.0 110.729 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.9 t 74.25 117.25 0.05 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.734 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.801 ' HA ' HD12 ' A' ' 22' ' ' LEU . 7.1 mp -79.16 159.02 73.81 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.902 174.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -30.18 106.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 124.53 3.487 . . . . 0.0 113.816 179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.76 118.38 5.55 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 123.227 2.618 . . . . 0.0 112.972 -174.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -56.87 -41.07 79.4 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.052 2.502 . . . . 0.0 113.517 171.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -53.85 118.09 4.58 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.731 1.621 . . . . 0.0 111.408 171.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 61.88 -117.39 0.63 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.408 -169.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -153.59 150.73 23.87 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -50.69 -31.28 31.8 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 123.102 2.535 . . . . 0.0 111.854 171.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.446 ' O ' ' HB3' ' A' ' 37' ' ' SER . 48.0 tpp -97.94 17.23 18.71 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.222 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 1.058 ' HB3' ' HB2' ' A' ' 40' ' ' ARG . 38.0 t 71.47 142.84 0.06 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.307 0.643 . . . . 0.0 110.689 -174.635 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.91 -31.58 64.74 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.178 0.514 . . . . 0.0 109.65 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -78.82 -46.17 19.29 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.953 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 1.058 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 7.6 mmm180 -66.87 -40.7 87.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.924 -177.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.0 p -64.15 -29.86 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.658 0.742 . . . . 0.0 109.74 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.658 ' O ' HG13 ' A' ' 46' ' ' ILE . 50.4 ttp180 -76.68 -47.82 20.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.99 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.631 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -58.45 -42.17 86.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.652 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -60.11 -24.54 64.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.706 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.614 ' O ' HG21 ' A' ' 49' ' ' ILE . 4.8 t60 -82.58 -39.64 21.98 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.698 HG12 ' HG ' ' A' ' 64' ' ' LEU . 9.6 mt -62.58 -27.76 43.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.016 177.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.41 -48.23 35.57 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.594 -174.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.564 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -71.63 -32.77 68.33 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.675 -173.177 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.887 HG22 HG21 ' A' ' 60' ' ' THR . 4.9 tp -82.99 -30.91 8.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.543 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.472 ' CE1' HD23 ' A' ' 75' ' ' LEU . 22.8 t80 -55.11 -40.07 70.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.362 0.601 . . . . 0.0 109.581 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.62 -30.69 61.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.123 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.62 ' HB2' HD13 ' A' ' 49' ' ' ILE . 92.8 mmm -58.44 -56.61 19.91 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.135 0.493 . . . . 0.0 111.48 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 40.7 t -97.86 3.06 49.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.946 -172.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.1 t70 67.05 80.76 0.21 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.74 -178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.445 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 47.2 mtp180 63.74 13.99 7.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 167.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -83.21 112.25 19.69 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.208 0.527 . . . . 0.0 110.79 176.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.93 -35.59 75.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.779 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 m -60.0 -50.24 74.51 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.186 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.612 ' HG3' HD12 ' A' ' 49' ' ' ILE . 8.4 tp10 -69.08 -37.72 78.62 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -178.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.887 HG21 HG22 ' A' ' 49' ' ' ILE . 38.3 m -54.5 -56.44 18.77 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.649 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.67 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . . . -56.5 -33.94 66.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.62 -177.547 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 8.2 tpt180 -66.24 -30.24 70.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.229 0.538 . . . . 0.0 110.749 178.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.667 ' HB3' HD11 ' A' ' 64' ' ' LEU . 1.2 tpt180 -73.34 -53.08 11.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.018 -178.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.698 ' HG ' HG12 ' A' ' 46' ' ' ILE . 0.0 OUTLIER -88.14 12.11 14.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.703 -175.371 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 t30 59.03 37.69 24.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 110.739 173.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.698 ' HB2' HD22 ' A' ' 64' ' ' LEU . 8.7 mtp -112.73 165.54 12.19 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.713 -175.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.406 ' HB3' ' OG1' ' A' ' 70' ' ' THR . 28.9 t60 -82.64 153.61 25.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.497 -1.229 . . . . 0.0 108.691 177.569 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -55.95 -47.43 77.58 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.608 0.242 . . . . 0.0 111.329 -175.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -64.15 -31.65 72.93 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.472 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.472 HG23 ' HE1' ' A' ' 66' ' ' MET . 6.6 m -60.26 -49.78 76.25 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.234 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.787 HD22 HG23 ' A' ' 60' ' ' THR . 0.3 OUTLIER -60.08 -46.44 89.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.378 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -58.17 -48.87 78.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.386 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -63.37 -50.06 71.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.04 0.447 . . . . 0.0 110.617 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.437 HG22 ' CD1' ' A' ' 46' ' ' ILE . 64.9 mt -58.92 -50.09 80.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.942 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.478 ' HA ' ' HH2' ' A' ' 43' ' ' TRP . 15.4 tp -61.87 -38.64 89.03 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.957 -178.099 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -81.22 -18.04 47.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.903 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -78.46 -17.83 55.74 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.927 -172.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -48.27 97.03 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -171.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.519 ' HB3' ' HD2' ' A' ' 80' ' ' PRO . 67.1 m -162.15 166.05 14.82 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.469 175.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.519 ' HD2' ' HB3' ' A' ' 79' ' ' SER . 71.9 Cg_endo -71.94 34.48 0.29 Allowed 'Trans proline' 0 N--CA 1.477 0.541 0 C-N-CA 122.977 2.451 . . . . 0.0 112.01 175.436 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.492 ' H ' ' C ' ' A' ' 79' ' ' SER . 57.8 ttt180 . . . . . 0 C--O 1.244 0.784 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.875 -177.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 1.7 tm? . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 120.706 0.288 . . . . 0.0 110.368 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.31 148.35 43.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.752 0.31 . . . . 0.0 111.524 -175.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.439 ' C ' ' H ' ' A' ' 26' ' ' GLU . 47.8 mttp -69.19 -23.94 63.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.325 175.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.13 24.01 2.57 Favored Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.167 176.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.439 ' H ' ' C ' ' A' ' 24' ' ' LYS . 15.9 tp10 -65.49 -46.24 80.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.495 0.664 . . . . 0.0 109.611 176.133 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.1 m -156.19 -37.18 0.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.663 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.472 HD11 ' HD2' ' A' ' 29' ' ' PRO . 43.3 tp 67.81 107.56 0.03 OUTLIER Pre-proline 0 C--N 1.341 0.212 0 O-C-N 124.136 0.897 . . . . 0.0 110.134 -176.723 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.472 ' HD2' HD11 ' A' ' 28' ' ' LEU . 33.6 Cg_exo -26.9 103.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 125.177 3.918 . . . . 0.0 114.246 -176.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.677 ' HG2' ' HD3' ' A' ' 31' ' ' PRO . 1.7 Cg_endo -47.09 -47.96 15.73 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.361 2.708 . . . . 0.0 114.363 -178.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.677 ' HD3' ' HG2' ' A' ' 30' ' ' PRO . 6.1 Cg_exo -79.1 116.47 3.68 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.773 1.649 . . . . 0.0 111.637 176.283 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.13 -31.56 23.07 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.433 2.089 . . . . 0.0 111.539 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.92 149.47 7.76 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.483 177.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.59 ' HB2' ' HD2' ' A' ' 35' ' ' PRO . 21.1 p30 -130.78 174.66 4.41 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -176.515 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.59 ' HD2' ' HB2' ' A' ' 34' ' ' ASN . 6.0 Cg_exo -40.67 -42.15 4.02 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 124.01 3.14 . . . . 0.0 113.886 173.383 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.694 ' O ' ' HB2' ' A' ' 40' ' ' ARG . 33.1 mmm -82.35 -3.06 54.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.378 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.485 ' O ' HG22 ' A' ' 41' ' ' VAL . 45.7 m 65.8 125.42 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.043 0.537 . . . . 0.0 111.25 -176.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.51 -29.63 70.11 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.433 0.635 . . . . 0.0 109.449 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -74.13 -43.37 57.77 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.425 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.694 ' HB2' ' O ' ' A' ' 36' ' ' MET . 59.6 mtp180 -67.87 -34.42 76.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.652 -178.289 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.485 HG22 ' O ' ' A' ' 37' ' ' SER . 92.4 t -58.45 -42.2 83.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.107 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.667 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.7 mtm180 -67.27 -48.47 67.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.314 176.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.55 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -55.85 -41.26 74.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.172 -177.64 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.57 -37.68 70.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.697 177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.727 ' O ' HG21 ' A' ' 49' ' ' ILE . 3.0 t60 -77.26 -35.86 54.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.713 ' CD1' HG23 ' A' ' 74' ' ' ILE . 14.7 mt -63.26 -36.02 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.695 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -72.5 -49.74 30.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.01 -175.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.481 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.93 -28.63 69.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.47 -176.679 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 1.013 HG22 HG22 ' A' ' 60' ' ' THR . 3.4 tp -86.14 -41.98 15.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.192 177.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.437 ' CE2' ' HA ' ' A' ' 55' ' ' ARG . 23.5 t80 -58.89 -32.8 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 0.0 110.379 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -72.83 -43.64 62.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.306 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.56 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 25.5 ptm -76.01 -41.23 51.67 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -173.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.474 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 28.6 p -81.43 -3.25 52.37 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.908 0.385 . . . . 0.0 110.679 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.2 t70 60.48 76.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.572 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.437 ' HA ' ' CE2' ' A' ' 50' ' ' TYR . 64.6 mtt180 64.76 15.97 10.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.538 170.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.474 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 53.4 t-20 -85.41 97.52 10.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.022 0.439 . . . . 0.0 109.965 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.402 HG22 HD13 ' A' ' 71' ' ' LEU . 9.4 p -62.54 -29.7 47.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.309 -177.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.7 m -65.73 -48.93 70.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.319 -176.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.778 ' HG2' HD12 ' A' ' 49' ' ' ILE . 20.7 tt0 -74.68 -35.81 62.78 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.73 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 1.013 HG22 HG22 ' A' ' 49' ' ' ILE . 33.4 m -52.86 -42.03 64.85 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.46 -52.56 64.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.679 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -60.19 -41.5 93.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.462 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.614 ' HD3' HD11 ' A' ' 49' ' ' ILE . 0.7 OUTLIER -72.8 -18.62 61.46 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.394 -178.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.537 HD22 ' O ' ' A' ' 60' ' ' THR . 2.8 mm? -93.21 -2.42 55.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.176 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.4 m120 63.68 26.54 14.58 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.687 0.756 . . . . 0.0 109.422 -176.267 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.459 ' HE1' HG21 ' A' ' 70' ' ' THR . 10.9 mtp -120.5 157.47 29.35 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.548 -172.083 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -74.67 154.24 38.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.077 174.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . 0.409 ' O ' ' HD2' ' A' ' 68' ' ' ARG . 2.6 tmm_? -55.2 -42.12 72.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.218 -175.379 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -67.81 -33.83 75.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.304 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.459 HG21 ' HE1' ' A' ' 66' ' ' MET . 6.7 m -59.68 -49.46 77.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.1 0.476 . . . . 0.0 110.132 177.066 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.811 HD22 HG21 ' A' ' 60' ' ' THR . 0.3 OUTLIER -61.57 -43.92 97.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.832 178.562 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -64.07 -46.51 83.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.41 -176.742 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -62.03 -35.18 77.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.995 0.426 . . . . 0.0 110.218 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.713 HG23 ' CD1' ' A' ' 46' ' ' ILE . 78.2 mt -68.95 -47.46 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.999 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.412 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 92.9 mt -58.32 -43.56 88.23 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.594 0.712 . . . . 0.0 109.778 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -75.7 -4.08 38.34 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.74 -174.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.1 ttmt -79.3 -25.02 42.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.08 176.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 78' ' ' ARG . 16.3 mtp180 -80.71 74.78 7.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.574 0.702 . . . . 0.0 110.741 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.794 ' HB3' ' HD2' ' A' ' 80' ' ' PRO . 69.2 m -159.77 175.83 2.95 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.008 -0.996 . . . . 0.0 108.541 -177.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.794 ' HD2' ' HB3' ' A' ' 79' ' ' SER . 73.5 Cg_endo -70.25 41.9 0.36 Allowed 'Trans proline' 0 N--CA 1.482 0.804 0 C-N-CA 123.164 2.576 . . . . 0.0 112.555 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.652 ' HE ' ' HA ' ' A' ' 81' ' ' ARG . 1.5 mmp_? . . . . . 0 C--N 1.314 -0.944 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.431 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.527 ' H3 ' HD11 ' A' ' 22' ' ' LEU . 5.5 mp . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.664 0.269 . . . . 0.0 110.447 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.4 110.28 2.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.064 0.459 . . . . 0.0 111.135 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -109.17 105.92 15.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.046 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 137.59 -75.92 0.37 Allowed Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.513 -176.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.92 -33.22 75.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.16 0.505 . . . . 0.0 110.132 175.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.3 m -106.46 90.43 3.34 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 172.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tt -101.41 127.33 31.88 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.72 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -31.65 111.09 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 124.754 3.636 . . . . 0.0 113.997 176.732 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -74.32 126.83 10.68 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 122.618 2.212 . . . . 0.0 111.997 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -59.61 134.88 60.63 Favored 'Trans proline' 0 C--O 1.233 0.272 0 C-N-CA 122.731 2.287 . . . . 0.0 111.655 178.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -57.56 -48.31 17.75 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.729 2.286 . . . . 0.0 111.775 179.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . 0.556 ' HA ' ' HA ' ' A' ' 38' ' ' ALA . 9.7 pt-20 -91.14 83.49 5.57 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.477 0.656 . . . . 0.0 110.385 177.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.491 ' OD1' ' HD2' ' A' ' 35' ' ' PRO . 66.1 t30 -75.13 136.68 72.59 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.333 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.491 ' HD2' ' OD1' ' A' ' 34' ' ' ASN . 5.8 Cg_exo -38.97 -37.52 0.87 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.146 3.231 . . . . 0.0 113.62 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 45.2 ttm -64.67 -52.38 57.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.236 0.541 . . . . 0.0 110.801 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.887 ' HB3' ' HB3' ' A' ' 40' ' ' ARG . 67.7 m -156.33 136.63 12.98 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.556 ' HA ' ' HA ' ' A' ' 33' ' ' GLU . . . -88.97 -59.79 2.13 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.567 -178.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -84.92 -30.59 24.22 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.727 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.887 ' HB3' ' HB3' ' A' ' 37' ' ' SER . 61.1 ttt180 -62.15 -45.61 92.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.427 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.773 HG22 ' HB2' ' A' ' 37' ' ' SER . 76.6 t -66.76 -36.9 78.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.67 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.724 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.3 mtm180 -64.09 -49.23 73.04 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.643 178.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.592 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.8 -41.75 98.14 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.129 0.49 . . . . 0.0 110.082 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -57.29 -35.53 69.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.259 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.627 ' O ' HG21 ' A' ' 49' ' ' ILE . 3.7 t60 -75.31 -37.16 60.94 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.789 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.724 HG13 ' O ' ' A' ' 42' ' ' ARG . 12.5 mt -62.76 -36.59 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.16 0.505 . . . . 0.0 110.266 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -72.05 -49.21 38.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.756 -176.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -30.26 69.85 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.736 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.985 HG22 HG22 ' A' ' 60' ' ' THR . 3.1 tp -86.28 -43.15 16.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.702 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 19.2 t80 -57.21 -39.85 76.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.533 -176.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.6 -39.47 67.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.789 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.589 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 15.2 ptp -76.82 -31.28 56.81 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.911 -174.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.541 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 9.7 t -92.77 10.88 28.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.949 0.404 . . . . 0.0 110.605 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.3 t70 58.04 65.64 1.26 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 82.2 mtt180 59.41 23.15 11.67 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.309 172.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.541 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 48.8 t30 -91.82 111.45 22.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.233 0.54 . . . . 0.0 110.343 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -71.82 -27.34 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.898 -172.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 53.7 p -63.05 -50.27 71.27 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.146 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.546 ' HG3' HD12 ' A' ' 49' ' ' ILE . 13.2 tp10 -69.75 -37.67 76.52 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.074 177.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.985 HG22 HG22 ' A' ' 49' ' ' ILE . 32.5 m -55.43 -51.91 65.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.815 0.341 . . . . 0.0 110.219 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -62.43 -44.14 97.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.229 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -41.3 95.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.112 0.482 . . . . 0.0 109.949 -177.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.604 ' HD3' HD11 ' A' ' 49' ' ' ILE . 40.9 ttt85 -79.81 -13.08 59.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.079 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.514 HD22 ' O ' ' A' ' 60' ' ' THR . 3.0 mm? -89.57 -6.59 56.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.53 170.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.8 t30 59.89 36.43 21.83 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 122.12 0.962 . . . . 0.0 108.901 -178.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.724 ' SD ' ' HB ' ' A' ' 70' ' ' THR . 2.6 tmm? -140.37 157.84 44.93 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.392 -165.416 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . 0.486 ' N ' ' HG2' ' A' ' 66' ' ' MET . 0.0 OUTLIER -81.76 149.8 28.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.438 -177.788 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -24.2 67.48 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -176.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -60.63 -29.41 69.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.333 0.587 . . . . 0.0 110.111 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.724 ' HB ' ' SD ' ' A' ' 66' ' ' MET . 8.7 m -83.9 -53.09 5.84 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.173 -0.922 . . . . 0.0 110.314 176.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.83 HD22 HG21 ' A' ' 60' ' ' THR . 0.2 OUTLIER -54.61 -52.06 63.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.927 0.491 . . . . 0.0 110.879 -178.376 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.85 -46.38 89.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.592 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -65.05 -32.16 73.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.915 0.388 . . . . 0.0 111.105 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.603 HG23 ' CD1' ' A' ' 46' ' ' ILE . 82.8 mt -67.28 -46.87 82.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.694 175.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 53.1 mt -65.19 -46.87 79.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.445 0.64 . . . . 0.0 110.245 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.11 -10.48 57.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.118 -174.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.463 ' O ' ' HD3' ' A' ' 77' ' ' LYS . 7.8 tmtm? -71.21 -26.11 62.8 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -79.34 46.97 0.77 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.747 0.784 . . . . 0.0 110.187 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.491 ' HB3' ' HD2' ' A' ' 80' ' ' PRO . 49.5 m -154.07 179.22 1.36 Allowed Pre-proline 0 C--N 1.318 -0.763 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.491 ' HD2' ' HB3' ' A' ' 79' ' ' SER . 32.8 Cg_exo -60.04 -25.99 81.23 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 121.888 1.725 . . . . 0.0 111.634 174.578 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.41 ' C ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.776 0 CA-C-O 117.787 -1.101 . . . . 0.0 110.297 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.767 ' HB2' ' HB2' ' A' ' 26' ' ' GLU . 86.1 mt . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.9 -155.53 0.12 Allowed 'General case' 0 C--O 1.235 0.31 0 O-C-N 123.241 0.338 . . . . 0.0 111.749 -178.3 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.569 ' HB2' ' HZ3' ' A' ' 24' ' ' LYS . 4.8 ttmp? -53.56 -39.88 65.11 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.168 0.587 . . . . 0.0 112.162 -175.411 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -59.88 -21.37 55.45 Favored Glycine 0 CA--C 1.519 0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 113.133 -178.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.767 ' HB2' ' HB2' ' A' ' 22' ' ' LEU . 10.6 tp10 -88.5 -68.15 0.79 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.4 t 179.05 164.95 0.9 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -177.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.64 133.57 86.67 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' PRO . . . . . 0.446 ' HA ' ' HD2' ' A' ' 30' ' ' PRO . 32.4 Cg_exo -30.1 112.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 124.88 3.72 . . . . 0.0 114.431 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.483 ' HG2' ' HD3' ' A' ' 31' ' ' PRO . 8.7 Cg_endo -53.09 -37.18 79.03 Favored 'Trans proline' 0 CA--C 1.551 1.353 0 C-N-CA 123.615 2.877 . . . . 0.0 115.709 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.483 ' HD3' ' HG2' ' A' ' 30' ' ' PRO . 65.6 Cg_exo -43.09 145.82 1.14 Allowed 'Trans proline' 0 C--N 1.37 1.7 0 C-N-CA 122.507 2.138 . . . . 0.0 113.765 177.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -60.7 162.59 17.91 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 123.33 2.687 . . . . 0.0 113.183 -177.168 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 66.98 -167.52 0.21 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.998 -174.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.417 ' HA ' ' HD2' ' A' ' 35' ' ' PRO . 57.2 t30 -118.62 126.44 27.16 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 176.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.417 ' HD2' ' HA ' ' A' ' 34' ' ' ASN . 3.8 Cg_exo -37.54 -39.28 0.68 Allowed 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 124.457 3.438 . . . . 0.0 113.736 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' MET . . . . . 0.417 ' O ' ' HG3' ' A' ' 36' ' ' MET . 19.6 ptp -104.11 85.62 2.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.703 0.763 . . . . 0.0 110.808 177.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' SER . . . . . 0.474 ' O ' HG21 ' A' ' 41' ' ' VAL . 26.2 t -76.01 165.55 24.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 172.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.29 -37.37 86.95 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -70.38 -37.94 74.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.97 -1.014 . . . . 0.0 110.111 175.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.414 ' HG2' ' O ' ' A' ' 35' ' ' PRO . 11.3 tpt180 -64.87 -45.13 87.31 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.784 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.474 HG21 ' O ' ' A' ' 37' ' ' SER . 76.1 t -57.52 -42.04 80.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.879 0.371 . . . . 0.0 110.435 178.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.731 ' O ' HG13 ' A' ' 46' ' ' ILE . 24.6 mtm180 -64.35 -49.21 72.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.442 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.564 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.64 -37.06 82.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.029 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -59.68 -34.64 73.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' HIS . . . . . 0.606 ' O ' HG21 ' A' ' 49' ' ' ILE . 5.1 t60 -79.99 -31.99 39.78 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.775 ' CD1' HG23 ' A' ' 74' ' ' ILE . 24.1 mt -69.09 -35.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.766 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 83.5 mm-40 -73.1 -48.8 32.64 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.021 0.439 . . . . 0.0 109.896 -177.628 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.657 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -59.81 -30.69 69.09 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.447 -178.451 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ILE . . . . . 0.851 HG22 HG22 ' A' ' 60' ' ' THR . 4.1 tp -86.07 -35.81 9.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.088 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.589 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 2.2 t80 -59.86 -36.41 76.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.233 0.54 . . . . 0.0 109.716 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.454 ' HG3' ' O ' ' A' ' 47' ' ' GLN . 45.4 mt-10 -73.51 -34.04 65.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.465 175.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' MET . . . . . 0.657 ' HG2' ' O ' ' A' ' 48' ' ' ARG . 74.0 mmm -59.36 -61.26 2.76 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.068 0.461 . . . . 0.0 112.23 -176.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.592 ' HB3' ' HB3' ' A' ' 56' ' ' ASN . 6.2 t -103.36 21.24 16.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.821 -170.139 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.8 t0 56.95 72.34 0.52 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.858 175.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.57 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 78.6 mtt180 62.15 21.4 12.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.906 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . 0.592 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 41.0 t-20 -76.07 95.52 3.64 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 175.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.75 -34.17 61.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.097 -177.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 m -59.04 -51.54 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.573 ' OE1' ' HD2' ' A' ' 62' ' ' ARG . 6.0 tp10 -67.02 -38.68 86.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' THR . . . . . 0.856 HG21 HD22 ' A' ' 71' ' ' LEU . 30.4 m -57.39 -56.0 27.49 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.81 -178.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.465 ' HA ' HD21 ' A' ' 71' ' ' LEU . . . -55.81 -42.68 76.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.598 0.237 . . . . 0.0 110.913 178.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.573 ' HD2' ' OE1' ' A' ' 59' ' ' GLU . 0.3 OUTLIER -66.91 -44.63 80.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.105 0.479 . . . . 0.0 110.566 -177.466 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.595 ' HD3' HD11 ' A' ' 49' ' ' ILE . 12.8 ttt180 -75.38 -20.07 59.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.698 -177.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LEU . . . . . 0.738 ' HB3' ' SD ' ' A' ' 66' ' ' MET . 3.1 mm? -86.18 -11.52 52.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.711 174.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.4 m120 69.66 31.64 3.55 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.102 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' MET . . . . . 0.738 ' SD ' ' HB3' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -127.24 168.4 14.78 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.863 0.839 . . . . 0.0 112.123 178.761 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -80.69 161.68 24.51 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.127 -1.397 . . . . 0.0 109.566 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 19.1 tpp85 -52.02 -51.79 55.03 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.924 0.392 . . . . 0.0 111.761 -178.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -64.11 -28.52 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.925 -176.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' THR . . . . . 0.503 HG21 ' HE1' ' A' ' 66' ' ' MET . 3.9 m -62.36 -58.6 7.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.402 176.008 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.856 HD22 HG21 ' A' ' 60' ' ' THR . 0.2 OUTLIER -55.96 -46.23 78.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.318 -179.234 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -56.74 -46.4 81.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.319 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.4 mtm180 -69.97 -29.42 66.52 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.775 HG23 ' CD1' ' A' ' 46' ' ' ILE . 1.4 mp -71.79 -43.66 69.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.132 174.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.509 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 78.0 mt -60.8 -46.3 91.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.483 0.659 . . . . 0.0 109.439 175.153 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.84 -11.73 60.21 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.624 -175.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.642 ' HE2' ' HB3' ' A' ' 81' ' ' ARG . 14.8 tmtt? -68.95 -18.5 64.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.086 178.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -77.97 39.72 0.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.103 -175.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' SER . . . . . 0.803 ' HB2' ' HD3' ' A' ' 80' ' ' PRO . 49.5 m -147.83 -54.35 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.079 177.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PRO . . . . . 0.803 ' HD3' ' HB2' ' A' ' 79' ' ' SER . 9.0 Cg_exo -72.96 -19.16 23.6 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.868 2.379 . . . . 0.0 112.496 178.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.642 ' HB3' ' HE2' ' A' ' 77' ' ' LYS . 14.1 tpt180 . . . . . 0 C--O 1.245 0.86 0 CA-C-O 118.425 -0.798 . . . . 0.0 110.717 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 81.9 t . . . . . 0 C--O 1.236 0.373 0 CA-C-O 120.716 0.293 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.701 ' O ' HG13 ' A' ' 46' ' ' ILE . 52.1 mtm180 -67.06 -49.47 65.02 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.528 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.616 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -58.75 -38.13 77.75 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.428 0.632 . . . . 0.0 109.834 -178.758 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.16 -30.89 71.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.716 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.754 ' O ' HG22 ' A' ' 49' ' ' ILE . 6.2 t60 -81.96 -32.0 30.95 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.718 HG23 HD21 ' A' ' 71' ' ' LEU . 11.7 mt -60.14 -37.36 72.84 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.354 177.349 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -74.22 -49.06 24.97 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.853 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.08 -29.45 69.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.653 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.927 HG23 HG23 ' A' ' 60' ' ' THR . 2.9 tp -85.25 -42.22 16.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.854 176.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 17.0 t80 -57.63 -31.71 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.09 0.472 . . . . 0.0 110.415 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -72.04 -48.66 42.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.39 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.522 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 24.5 ptm -74.2 -31.37 62.61 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -171.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.467 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 28.1 p -89.7 0.9 56.68 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.066 -0.396 . . . . 0.0 110.647 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.1 t70 56.3 62.1 2.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.003 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 69.9 20.52 6.63 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.055 172.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.467 ' HB3' ' HB2' ' A' ' 53' ' ' CYS . 49.7 t-20 -78.12 100.56 6.62 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 174.254 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 HD12 ' A' ' 71' ' ' LEU . 47.4 t -65.49 -28.86 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.313 -176.641 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.0 m -68.58 -48.1 65.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.824 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.423 ' HG3' HD11 ' A' ' 49' ' ' ILE . 10.2 tp10 -62.3 -42.26 99.21 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 109.82 177.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.927 HG23 HG23 ' A' ' 49' ' ' ILE . 27.9 m -59.08 -54.26 49.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.977 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.614 ' HA ' ' SD ' ' A' ' 66' ' ' MET . . . -61.32 -35.32 77.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.834 0.35 . . . . 0.0 111.667 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -74.99 -31.32 61.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.444 0.64 . . . . 0.0 109.763 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.672 ' HD3' HD13 ' A' ' 49' ' ' ILE . 46.2 ttt85 -83.28 -16.37 46.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.139 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 45' ' ' HIS . 4.1 mm? -95.35 -10.4 30.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.011 175.297 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 62.94 69.65 0.58 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.055 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.978 ' HG3' ' HB ' ' A' ' 70' ' ' THR . 0.1 OUTLIER -160.32 174.33 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.198 -177.507 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.57 152.58 25.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.567 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.457 ' HD2' ' O ' ' A' ' 68' ' ' ARG . 2.9 tmm_? -56.4 -37.77 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.112 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 mmt180 -61.4 -37.58 83.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.167 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.978 ' HB ' ' HG3' ' A' ' 66' ' ' MET . 5.4 m -59.87 -52.44 65.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.629 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.842 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -59.45 -45.12 92.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.588 178.418 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -59.77 -50.01 75.48 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.386 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -61.86 -38.51 88.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.7 0.286 . . . . 0.0 110.612 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.584 HG21 ' CD1' ' A' ' 46' ' ' ILE . 91.3 mt -62.06 -41.58 91.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.647 177.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 43.8 mt -70.11 -40.68 74.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.682 0.754 . . . . 0.0 110.169 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.705 -170.276 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 121.658 0.742 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.671 ' O ' HG13 ' A' ' 46' ' ' ILE . 50.4 ttp180 -76.68 -47.82 20.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.99 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.629 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -58.45 -42.17 86.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.652 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -60.11 -24.54 64.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.706 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.628 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.8 t60 -82.58 -39.64 21.98 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.728 HG12 ' HG ' ' A' ' 64' ' ' LEU . 9.6 mt -62.58 -27.76 43.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.016 177.835 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.41 -48.23 35.57 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.594 -174.319 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.576 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -71.63 -32.77 68.33 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.675 -173.177 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.888 HG23 HG23 ' A' ' 60' ' ' THR . 4.9 tp -82.99 -30.91 8.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.543 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.48 ' CE1' HD21 ' A' ' 75' ' ' LEU . 22.8 t80 -55.11 -40.07 70.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.362 0.601 . . . . 0.0 109.581 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.62 -30.69 61.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.123 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.619 ' HB2' HD12 ' A' ' 49' ' ' ILE . 92.8 mmm -58.44 -56.61 19.91 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.135 0.493 . . . . 0.0 111.48 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.403 ' HB2' ' HG2' ' A' ' 59' ' ' GLU . 40.7 t -97.86 3.06 49.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.946 -172.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.1 t70 67.05 80.76 0.21 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.74 -178.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.466 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 47.2 mtp180 63.74 13.99 7.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 167.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -83.21 112.25 19.69 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.208 0.527 . . . . 0.0 110.79 176.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.93 -35.59 75.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.779 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 m -60.0 -50.24 74.51 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.186 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.642 ' HG3' HD11 ' A' ' 49' ' ' ILE . 8.4 tp10 -69.08 -37.72 78.62 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -178.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.888 HG23 HG23 ' A' ' 49' ' ' ILE . 38.3 m -54.5 -56.44 18.77 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.649 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.687 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . . . -56.5 -33.94 66.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.62 -177.547 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 62' ' ' ARG . 8.2 tpt180 -66.24 -30.24 70.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.229 0.538 . . . . 0.0 110.749 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.745 ' HD3' HD13 ' A' ' 49' ' ' ILE . 1.2 tpt180 -73.34 -53.08 11.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.018 -178.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.752 HD23 ' HB2' ' A' ' 66' ' ' MET . 0.0 OUTLIER -88.14 12.11 14.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.703 -175.371 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 t30 59.03 37.69 24.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 110.739 173.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.752 ' HB2' HD23 ' A' ' 64' ' ' LEU . 8.7 mtp -112.73 165.54 12.19 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.713 -175.271 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.423 ' HB3' ' OG1' ' A' ' 70' ' ' THR . 28.9 t60 -82.64 153.61 25.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.497 -1.229 . . . . 0.0 108.691 177.569 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -55.95 -47.43 77.58 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.608 0.242 . . . . 0.0 111.329 -175.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -64.15 -31.65 72.93 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.472 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.437 HG22 ' HE3' ' A' ' 66' ' ' MET . 6.6 m -60.26 -49.78 76.25 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.234 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.712 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -60.08 -46.44 89.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.378 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -58.17 -48.87 78.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.386 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -63.37 -50.06 71.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.04 0.447 . . . . 0.0 110.617 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.535 HG21 ' CD1' ' A' ' 46' ' ' ILE . 64.9 mt -58.92 -50.09 80.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.942 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.492 ' HA ' ' HH2' ' A' ' 43' ' ' TRP . 15.4 tp -61.87 -38.64 89.03 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.957 -178.099 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.903 -175.31 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.4 t . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.802 0.334 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.678 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.7 mtm180 -67.27 -48.47 67.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.314 176.541 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.543 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -55.85 -41.26 74.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.172 -177.64 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.57 -37.68 70.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.697 177.082 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.747 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.0 t60 -77.26 -35.86 54.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.678 HG13 ' O ' ' A' ' 42' ' ' ARG . 14.7 mt -63.26 -36.02 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.695 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -72.5 -49.74 30.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.01 -175.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.93 -28.63 69.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.47 -176.679 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 1.012 HG23 HG23 ' A' ' 60' ' ' THR . 3.4 tp -86.14 -41.98 15.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.192 177.006 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.439 ' CZ ' ' HA ' ' A' ' 55' ' ' ARG . 23.5 t80 -58.89 -32.8 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 0.0 110.379 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -72.83 -43.64 62.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.306 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.569 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 25.5 ptm -76.01 -41.23 51.67 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -173.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 28.6 p -81.43 -3.25 52.37 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.908 0.385 . . . . 0.0 110.679 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.2 t70 60.48 76.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.572 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.439 ' HA ' ' CZ ' ' A' ' 50' ' ' TYR . 64.6 mtt180 64.76 15.97 10.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.538 170.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.488 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 53.4 t-20 -85.41 97.52 10.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.022 0.439 . . . . 0.0 109.965 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 HD12 ' A' ' 71' ' ' LEU . 9.4 p -62.54 -29.7 47.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.309 -177.439 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.7 m -65.73 -48.93 70.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.319 -176.983 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.698 ' HG2' HD11 ' A' ' 49' ' ' ILE . 20.7 tt0 -74.68 -35.81 62.78 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.73 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' THR . . . . . 1.012 HG23 HG23 ' A' ' 49' ' ' ILE . 33.4 m -52.86 -42.03 64.85 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.46 -52.56 64.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.679 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -60.19 -41.5 93.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.462 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.948 ' HD3' HD13 ' A' ' 49' ' ' ILE . 0.7 OUTLIER -72.8 -18.62 61.46 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.394 -178.818 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 46' ' ' ILE . 2.8 mm? -93.21 -2.42 55.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.176 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.2 m-20 63.68 26.54 14.58 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.687 0.756 . . . . 0.0 109.422 -176.267 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.486 ' HE3' HG22 ' A' ' 70' ' ' THR . 10.9 mtp -120.5 157.47 29.35 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.548 -172.083 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -74.67 154.24 38.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.077 174.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.412 ' HD2' ' O ' ' A' ' 68' ' ' ARG . 2.6 tmm_? -55.2 -42.12 72.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.218 -175.379 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -67.81 -33.83 75.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.304 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.486 HG22 ' HE3' ' A' ' 66' ' ' MET . 6.7 m -59.68 -49.46 77.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.1 0.476 . . . . 0.0 110.132 177.066 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.816 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -61.57 -43.92 97.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.832 178.562 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -64.07 -46.51 83.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.41 -176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -62.03 -35.18 77.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.995 0.426 . . . . 0.0 110.218 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.664 HG21 ' CD1' ' A' ' 46' ' ' ILE . 78.2 mt -68.95 -47.46 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.999 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 92.9 mt -58.32 -43.56 88.23 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.594 0.712 . . . . 0.0 109.778 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.74 -174.019 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 76.6 t . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.724 0.297 . . . . 0.0 110.67 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.738 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.3 mtm180 -64.09 -49.23 73.04 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.643 178.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.587 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.8 -41.75 98.14 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.129 0.49 . . . . 0.0 110.082 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -57.29 -35.53 69.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.259 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.663 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.7 t60 -75.31 -37.16 60.94 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.789 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.738 HG13 ' O ' ' A' ' 42' ' ' ARG . 12.5 mt -62.76 -36.59 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.16 0.505 . . . . 0.0 110.266 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -72.05 -49.21 38.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.756 -176.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -30.26 69.85 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.736 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.969 HD13 ' HD3' ' A' ' 63' ' ' ARG . 3.1 tp -86.28 -43.15 16.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.702 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 19.2 t80 -57.21 -39.85 76.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.533 -176.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.6 -39.47 67.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.789 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.61 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 15.2 ptp -76.82 -31.28 56.81 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.911 -174.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.553 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 9.7 t -92.77 10.88 28.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.949 0.404 . . . . 0.0 110.605 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.3 t70 58.04 65.64 1.26 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 82.2 mtt180 59.41 23.15 11.67 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.309 172.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.553 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 48.8 t30 -91.82 111.45 22.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.233 0.54 . . . . 0.0 110.343 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -71.82 -27.34 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.898 -172.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 53.7 p -63.05 -50.27 71.27 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.146 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.431 ' HG3' HD11 ' A' ' 49' ' ' ILE . 13.2 tp10 -69.75 -37.67 76.52 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.074 177.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.924 HG23 HG23 ' A' ' 49' ' ' ILE . 32.5 m -55.43 -51.91 65.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.815 0.341 . . . . 0.0 110.219 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.436 ' HA ' HD23 ' A' ' 71' ' ' LEU . . . -62.43 -44.14 97.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.229 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -41.3 95.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.112 0.482 . . . . 0.0 109.949 -177.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.969 ' HD3' HD13 ' A' ' 49' ' ' ILE . 40.9 ttt85 -79.81 -13.08 59.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.079 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.579 HD21 ' HA ' ' A' ' 46' ' ' ILE . 3.0 mm? -89.57 -6.59 56.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.53 170.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.8 t30 59.89 36.43 21.83 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 122.12 0.962 . . . . 0.0 108.901 -178.133 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.741 ' SD ' ' HB ' ' A' ' 70' ' ' THR . 2.6 tmm? -140.37 157.84 44.93 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.392 -165.416 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' HIS . . . . . 0.481 ' N ' ' HG2' ' A' ' 66' ' ' MET . 0.0 OUTLIER -81.76 149.8 28.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.438 -177.788 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -24.2 67.48 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -176.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -60.63 -29.41 69.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.333 0.587 . . . . 0.0 110.111 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.741 ' HB ' ' SD ' ' A' ' 66' ' ' MET . 8.7 m -83.9 -53.09 5.84 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.173 -0.922 . . . . 0.0 110.314 176.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.855 HD21 HG22 ' A' ' 60' ' ' THR . 0.2 OUTLIER -54.61 -52.06 63.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.927 0.491 . . . . 0.0 110.879 -178.376 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.85 -46.38 89.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.592 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -65.05 -32.16 73.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.915 0.388 . . . . 0.0 111.105 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.567 HG21 ' CD1' ' A' ' 46' ' ' ILE . 82.8 mt -67.28 -46.87 82.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.694 175.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 53.1 mt -65.19 -46.87 79.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.445 0.64 . . . . 0.0 110.245 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.118 -174.25 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 76.1 t . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.879 0.371 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.734 ' O ' HG13 ' A' ' 46' ' ' ILE . 24.6 mtm180 -64.35 -49.21 72.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.442 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.564 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.64 -37.06 82.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.029 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -59.68 -34.64 73.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 49' ' ' ILE . 5.1 t60 -79.99 -31.99 39.78 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.754 ' CD1' HG21 ' A' ' 74' ' ' ILE . 24.1 mt -69.09 -35.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.766 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 83.5 mm-40 -73.1 -48.8 32.64 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.021 0.439 . . . . 0.0 109.896 -177.628 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.671 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -59.81 -30.69 69.09 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.447 -178.451 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ILE . . . . . 0.877 HD13 ' HD3' ' A' ' 63' ' ' ARG . 4.1 tp -86.07 -35.81 9.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.088 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.605 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 2.2 t80 -59.86 -36.41 76.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.233 0.54 . . . . 0.0 109.716 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 47' ' ' GLN . 45.4 mt-10 -73.51 -34.04 65.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.465 175.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' MET . . . . . 0.671 ' HG2' ' O ' ' A' ' 48' ' ' ARG . 74.0 mmm -59.36 -61.26 2.76 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.068 0.461 . . . . 0.0 112.23 -176.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.609 ' HB3' ' HB3' ' A' ' 56' ' ' ASN . 6.2 t -103.36 21.24 16.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.821 -170.139 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.8 t0 56.95 72.34 0.52 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.858 175.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.578 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 78.6 mtt180 62.15 21.4 12.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.906 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASN . . . . . 0.609 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 41.0 t-20 -76.07 95.52 3.64 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 175.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.75 -34.17 61.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.097 -177.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 m -59.04 -51.54 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.59 ' OE1' ' HD2' ' A' ' 62' ' ' ARG . 6.0 tp10 -67.02 -38.68 86.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' THR . . . . . 0.857 HG22 HD21 ' A' ' 71' ' ' LEU . 30.4 m -57.39 -56.0 27.49 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.81 -178.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.566 ' HA ' HD23 ' A' ' 71' ' ' LEU . . . -55.81 -42.68 76.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.598 0.237 . . . . 0.0 110.913 178.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.59 ' HD2' ' OE1' ' A' ' 59' ' ' GLU . 0.3 OUTLIER -66.91 -44.63 80.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.105 0.479 . . . . 0.0 110.566 -177.466 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.877 ' HD3' HD13 ' A' ' 49' ' ' ILE . 12.8 ttt180 -75.38 -20.07 59.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.698 -177.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' LEU . . . . . 0.748 ' HB3' ' SD ' ' A' ' 66' ' ' MET . 3.1 mm? -86.18 -11.52 52.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.711 174.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 69.66 31.64 3.55 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.102 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' MET . . . . . 0.748 ' SD ' ' HB3' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -127.24 168.4 14.78 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.863 0.839 . . . . 0.0 112.123 178.761 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -80.69 161.68 24.51 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.127 -1.397 . . . . 0.0 109.566 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 68' ' ' ARG . 19.1 tpp85 -52.02 -51.79 55.03 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.924 0.392 . . . . 0.0 111.761 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . 0.446 ' HA ' ' HD3' ' A' ' 69' ' ' ARG . 26.5 mmt180 -64.11 -28.52 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.925 -176.546 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' THR . . . . . 0.434 ' HB ' ' HB2' ' A' ' 66' ' ' MET . 3.9 m -62.36 -58.6 7.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.402 176.008 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.857 HD21 HG22 ' A' ' 60' ' ' THR . 0.2 OUTLIER -55.96 -46.23 78.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.318 -179.234 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -56.74 -46.4 81.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.319 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.4 mtm180 -69.97 -29.42 66.52 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.754 HG21 ' CD1' ' A' ' 46' ' ' ILE . 1.4 mp -71.79 -43.66 69.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.132 174.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 78.0 mt -60.8 -46.3 91.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.483 0.659 . . . . 0.0 109.439 175.153 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.287 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.624 -175.668 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.51 ' O ' HD12 ' A' ' 22' ' ' LEU . 3.1 pp . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 120.589 0.233 . . . . 0.0 110.632 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 61.69 177.7 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.997 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -136.38 -162.91 1.33 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.184 176.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 73.68 -107.74 2.32 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.974 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -96.12 -7.11 36.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.9 0.381 . . . . 0.0 110.762 -176.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.5 m -80.89 -15.0 57.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.865 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.417 ' HA ' ' HD2' ' A' ' 29' ' ' PRO . 3.2 tt -132.22 95.75 20.84 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 30' ' ' PRO . 40.9 Cg_exo -32.32 119.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 125.119 3.879 . . . . 0.0 114.82 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.495 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 1.7 Cg_endo -85.08 132.02 4.45 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.406 2.737 . . . . 0.0 111.664 174.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.495 ' HD3' ' HA ' ' A' ' 30' ' ' PRO . 18.7 Cg_exo -67.5 172.87 9.67 Favored 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.951 2.434 . . . . 0.0 111.562 176.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -70.89 55.06 1.7 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.812 2.342 . . . . 0.0 112.268 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -62.75 -35.3 79.33 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.202 -177.747 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.407 ' HA ' ' HD2' ' A' ' 35' ' ' PRO . 78.2 m-20 -87.17 134.3 36.93 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.717 -176.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 34' ' ' ASN . 5.2 Cg_endo -48.68 -48.09 18.75 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.545 2.83 . . . . 0.0 112.198 174.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 67.0 mtt -86.91 74.4 9.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.601 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.666 ' HB3' ' HB2' ' A' ' 40' ' ' ARG . 25.0 t -73.03 161.94 30.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.581 176.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.8 96.92 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.073 0.463 . . . . 0.0 110.603 -172.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -87.49 -26.79 23.02 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.276 -0.569 . . . . 0.0 109.982 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.666 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 3.7 tmt_? -59.88 -44.08 94.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.737 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 37' ' ' SER . 81.9 t -60.64 -35.89 66.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.528 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.701 ' O ' HG13 ' A' ' 46' ' ' ILE . 52.1 mtm180 -67.06 -49.47 65.02 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.528 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.676 ' HZ2' ' HG2' ' A' ' 78' ' ' ARG . 0.0 OUTLIER -58.75 -38.13 77.75 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.428 0.632 . . . . 0.0 109.834 -178.758 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.16 -30.89 71.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.716 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.754 ' O ' HG22 ' A' ' 49' ' ' ILE . 6.2 t60 -81.96 -32.0 30.95 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.718 HG23 HD21 ' A' ' 71' ' ' LEU . 11.7 mt -60.14 -37.36 72.84 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.354 177.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -74.22 -49.06 24.97 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.853 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.08 -29.45 69.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.653 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.927 HG23 HG23 ' A' ' 60' ' ' THR . 2.9 tp -85.25 -42.22 16.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.854 176.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 17.0 t80 -57.63 -31.71 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.09 0.472 . . . . 0.0 110.415 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -72.04 -48.66 42.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.39 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.522 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 24.5 ptm -74.2 -31.37 62.61 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -171.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.467 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 28.1 p -89.7 0.9 56.68 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.066 -0.396 . . . . 0.0 110.647 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.1 t70 56.3 62.1 2.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.003 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 69.9 20.52 6.63 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.055 172.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.467 ' HB3' ' HB2' ' A' ' 53' ' ' CYS . 49.7 t-20 -78.12 100.56 6.62 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 174.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 HD12 ' A' ' 71' ' ' LEU . 47.4 t -65.49 -28.86 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.313 -176.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.0 m -68.58 -48.1 65.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.824 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.423 ' HG3' HD11 ' A' ' 49' ' ' ILE . 10.2 tp10 -62.3 -42.26 99.21 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 109.82 177.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.927 HG23 HG23 ' A' ' 49' ' ' ILE . 27.9 m -59.08 -54.26 49.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.977 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.614 ' HA ' ' SD ' ' A' ' 66' ' ' MET . . . -61.32 -35.32 77.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.834 0.35 . . . . 0.0 111.667 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -74.99 -31.32 61.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.444 0.64 . . . . 0.0 109.763 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.672 ' HD3' HD13 ' A' ' 49' ' ' ILE . 46.2 ttt85 -83.28 -16.37 46.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.139 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 45' ' ' HIS . 4.1 mm? -95.35 -10.4 30.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.011 175.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 62.94 69.65 0.58 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.055 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.978 ' HG3' ' HB ' ' A' ' 70' ' ' THR . 0.1 OUTLIER -160.32 174.33 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.198 -177.507 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.57 152.58 25.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.567 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.457 ' HD2' ' O ' ' A' ' 68' ' ' ARG . 2.9 tmm_? -56.4 -37.77 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.112 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 mmt180 -61.4 -37.58 83.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.167 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.978 ' HB ' ' HG3' ' A' ' 66' ' ' MET . 5.4 m -59.87 -52.44 65.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.629 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.842 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -59.45 -45.12 92.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.588 178.418 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -59.77 -50.01 75.48 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.386 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -61.86 -38.51 88.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.7 0.286 . . . . 0.0 110.612 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.584 HG21 ' CD1' ' A' ' 46' ' ' ILE . 91.3 mt -62.06 -41.58 91.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.647 177.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.589 ' HB3' HH21 ' A' ' 81' ' ' ARG . 43.8 mt -70.11 -40.68 74.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.682 0.754 . . . . 0.0 110.169 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.03 -22.39 59.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.705 -170.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -13.08 58.1 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.792 176.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.676 ' HG2' ' HZ2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -113.2 4.05 16.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.022 0.439 . . . . 0.0 111.106 -179.177 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 46.1 m -149.26 154.65 39.16 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.177 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -77.8 29.82 0.44 Allowed 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 122.767 2.311 . . . . 0.0 112.317 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.589 HH21 ' HB3' ' A' ' 75' ' ' LEU . 56.2 ttp180 . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.376 -176.249 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.821 HD11 ' HA ' ' A' ' 28' ' ' LEU . 2.4 pt? . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.91 141.26 58.83 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.991 0.424 . . . . 0.0 111.245 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -85.79 133.67 33.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.457 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.43 -3.53 77.53 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.345 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -102.05 26.23 7.86 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.854 0.359 . . . . 0.0 110.729 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.9 t 74.25 117.25 0.05 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.734 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.821 ' HA ' HD11 ' A' ' 22' ' ' LEU . 7.1 mp -79.16 159.02 73.81 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.902 174.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' A' ' 30' ' ' PRO . 35.6 Cg_exo -30.18 106.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 124.53 3.487 . . . . 0.0 113.816 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 29' ' ' PRO . 8.1 Cg_exo -72.76 118.38 5.55 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 123.227 2.618 . . . . 0.0 112.972 -174.328 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -56.87 -41.07 79.4 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.052 2.502 . . . . 0.0 113.517 171.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -53.85 118.09 4.58 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.731 1.621 . . . . 0.0 111.408 171.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 61.88 -117.39 0.63 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.408 -169.342 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -153.59 150.73 23.87 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -50.69 -31.28 31.8 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 123.102 2.535 . . . . 0.0 111.854 171.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.453 ' O ' ' HB3' ' A' ' 37' ' ' SER . 48.0 tpp -97.94 17.23 18.71 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.222 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' SER . . . . . 1.06 ' HB3' ' HB2' ' A' ' 40' ' ' ARG . 38.0 t 71.47 142.84 0.06 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.307 0.643 . . . . 0.0 110.689 -174.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.91 -31.58 64.74 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.178 0.514 . . . . 0.0 109.65 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -78.82 -46.17 19.29 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.953 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 1.06 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 7.6 mmm180 -66.87 -40.7 87.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.924 -177.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.0 p -64.15 -29.86 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.658 0.742 . . . . 0.0 109.74 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.671 ' O ' HG13 ' A' ' 46' ' ' ILE . 50.4 ttp180 -76.68 -47.82 20.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.99 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.629 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -58.45 -42.17 86.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.652 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -60.11 -24.54 64.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.706 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.628 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.8 t60 -82.58 -39.64 21.98 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.728 HG12 ' HG ' ' A' ' 64' ' ' LEU . 9.6 mt -62.58 -27.76 43.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.016 177.835 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.41 -48.23 35.57 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.594 -174.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.576 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -71.63 -32.77 68.33 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.675 -173.177 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.888 HG23 HG23 ' A' ' 60' ' ' THR . 4.9 tp -82.99 -30.91 8.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.543 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.48 ' CE1' HD21 ' A' ' 75' ' ' LEU . 22.8 t80 -55.11 -40.07 70.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.362 0.601 . . . . 0.0 109.581 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.62 -30.69 61.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.123 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.619 ' HB2' HD12 ' A' ' 49' ' ' ILE . 92.8 mmm -58.44 -56.61 19.91 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.135 0.493 . . . . 0.0 111.48 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.403 ' HB2' ' HG2' ' A' ' 59' ' ' GLU . 40.7 t -97.86 3.06 49.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.946 -172.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.1 t70 67.05 80.76 0.21 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.74 -178.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.466 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 47.2 mtp180 63.74 13.99 7.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 167.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -83.21 112.25 19.69 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.208 0.527 . . . . 0.0 110.79 176.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.93 -35.59 75.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.779 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 m -60.0 -50.24 74.51 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.186 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.642 ' HG3' HD11 ' A' ' 49' ' ' ILE . 8.4 tp10 -69.08 -37.72 78.62 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -178.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.888 HG23 HG23 ' A' ' 49' ' ' ILE . 38.3 m -54.5 -56.44 18.77 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.649 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.687 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . . . -56.5 -33.94 66.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.62 -177.547 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 62' ' ' ARG . 8.2 tpt180 -66.24 -30.24 70.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.229 0.538 . . . . 0.0 110.749 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.745 ' HD3' HD13 ' A' ' 49' ' ' ILE . 1.2 tpt180 -73.34 -53.08 11.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.018 -178.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.752 HD23 ' HB2' ' A' ' 66' ' ' MET . 0.0 OUTLIER -88.14 12.11 14.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.703 -175.371 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 t30 59.03 37.69 24.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 110.739 173.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.752 ' HB2' HD23 ' A' ' 64' ' ' LEU . 8.7 mtp -112.73 165.54 12.19 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.713 -175.271 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.423 ' HB3' ' OG1' ' A' ' 70' ' ' THR . 28.9 t60 -82.64 153.61 25.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.497 -1.229 . . . . 0.0 108.691 177.569 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -55.95 -47.43 77.58 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.608 0.242 . . . . 0.0 111.329 -175.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -64.15 -31.65 72.93 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.472 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.437 HG22 ' HE3' ' A' ' 66' ' ' MET . 6.6 m -60.26 -49.78 76.25 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.234 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.712 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -60.08 -46.44 89.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.378 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -58.17 -48.87 78.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.386 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -63.37 -50.06 71.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.04 0.447 . . . . 0.0 110.617 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.535 HG21 ' CD1' ' A' ' 46' ' ' ILE . 64.9 mt -58.92 -50.09 80.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.942 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.492 ' HA ' ' HH2' ' A' ' 43' ' ' TRP . 15.4 tp -61.87 -38.64 89.03 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.957 -178.099 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -81.22 -18.04 47.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.903 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -78.46 -17.83 55.74 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.927 -172.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -48.27 97.03 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -171.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.51 ' HB3' ' HD2' ' A' ' 80' ' ' PRO . 67.1 m -162.15 166.05 14.82 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.469 175.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.51 ' HD2' ' HB3' ' A' ' 79' ' ' SER . 71.9 Cg_endo -71.94 34.48 0.29 Allowed 'Trans proline' 0 N--CA 1.477 0.541 0 C-N-CA 122.977 2.451 . . . . 0.0 112.01 175.436 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.471 ' H ' ' C ' ' A' ' 79' ' ' SER . 57.8 ttt180 . . . . . 0 C--O 1.244 0.784 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.875 -177.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.406 ' O ' HD13 ' A' ' 22' ' ' LEU . 1.7 tm? . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 120.706 0.288 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.31 148.35 43.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.752 0.31 . . . . 0.0 111.524 -175.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -69.19 -23.94 63.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.325 175.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.13 24.01 2.57 Favored Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.167 176.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -65.49 -46.24 80.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.495 0.664 . . . . 0.0 109.611 176.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.1 m -156.19 -37.18 0.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.663 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.484 HD12 ' HD2' ' A' ' 29' ' ' PRO . 43.3 tp 67.81 107.56 0.03 OUTLIER Pre-proline 0 C--N 1.341 0.212 0 O-C-N 124.136 0.897 . . . . 0.0 110.134 -176.723 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.484 ' HD2' HD12 ' A' ' 28' ' ' LEU . 33.6 Cg_exo -26.9 103.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 125.177 3.918 . . . . 0.0 114.246 -176.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.664 ' HG2' ' HD3' ' A' ' 31' ' ' PRO . 1.7 Cg_endo -47.09 -47.96 15.73 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.361 2.708 . . . . 0.0 114.363 -178.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.664 ' HD3' ' HG2' ' A' ' 30' ' ' PRO . 6.1 Cg_exo -79.1 116.47 3.68 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.773 1.649 . . . . 0.0 111.637 176.283 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.13 -31.56 23.07 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.433 2.089 . . . . 0.0 111.539 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.92 149.47 7.76 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.483 177.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.6 ' HB2' ' HD2' ' A' ' 35' ' ' PRO . 21.1 p30 -130.78 174.66 4.41 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -176.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.6 ' HD2' ' HB2' ' A' ' 34' ' ' ASN . 6.0 Cg_exo -40.67 -42.15 4.02 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 124.01 3.14 . . . . 0.0 113.886 173.383 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.707 ' O ' ' HB2' ' A' ' 40' ' ' ARG . 33.1 mmm -82.35 -3.06 54.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.378 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.49 ' O ' HG23 ' A' ' 41' ' ' VAL . 45.7 m 65.8 125.42 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.043 0.537 . . . . 0.0 111.25 -176.429 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.51 -29.63 70.11 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.433 0.635 . . . . 0.0 109.449 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -74.13 -43.37 57.77 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.425 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.707 ' HB2' ' O ' ' A' ' 36' ' ' MET . 59.6 mtp180 -67.87 -34.42 76.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.652 -178.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 37' ' ' SER . 92.4 t -58.45 -42.2 83.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.107 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.678 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.7 mtm180 -67.27 -48.47 67.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.314 176.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.543 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -55.85 -41.26 74.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.172 -177.64 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.57 -37.68 70.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.697 177.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.747 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.0 t60 -77.26 -35.86 54.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.678 HG13 ' O ' ' A' ' 42' ' ' ARG . 14.7 mt -63.26 -36.02 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.695 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -72.5 -49.74 30.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.01 -175.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.93 -28.63 69.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.47 -176.679 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 1.012 HG23 HG23 ' A' ' 60' ' ' THR . 3.4 tp -86.14 -41.98 15.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.192 177.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.439 ' CZ ' ' HA ' ' A' ' 55' ' ' ARG . 23.5 t80 -58.89 -32.8 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 0.0 110.379 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -72.83 -43.64 62.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.306 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.569 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 25.5 ptm -76.01 -41.23 51.67 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -173.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 28.6 p -81.43 -3.25 52.37 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.908 0.385 . . . . 0.0 110.679 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.2 t70 60.48 76.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.572 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.439 ' HA ' ' CZ ' ' A' ' 50' ' ' TYR . 64.6 mtt180 64.76 15.97 10.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.538 170.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.488 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 53.4 t-20 -85.41 97.52 10.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.022 0.439 . . . . 0.0 109.965 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 HD12 ' A' ' 71' ' ' LEU . 9.4 p -62.54 -29.7 47.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.309 -177.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.7 m -65.73 -48.93 70.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.319 -176.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.698 ' HG2' HD11 ' A' ' 49' ' ' ILE . 20.7 tt0 -74.68 -35.81 62.78 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.73 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' THR . . . . . 1.012 HG23 HG23 ' A' ' 49' ' ' ILE . 33.4 m -52.86 -42.03 64.85 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.46 -52.56 64.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.679 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -60.19 -41.5 93.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.462 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.948 ' HD3' HD13 ' A' ' 49' ' ' ILE . 0.7 OUTLIER -72.8 -18.62 61.46 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.394 -178.818 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 46' ' ' ILE . 2.8 mm? -93.21 -2.42 55.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.176 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 52.2 m-20 63.68 26.54 14.58 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.687 0.756 . . . . 0.0 109.422 -176.267 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.486 ' HE3' HG22 ' A' ' 70' ' ' THR . 10.9 mtp -120.5 157.47 29.35 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.548 -172.083 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -74.67 154.24 38.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.077 174.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.412 ' HD2' ' O ' ' A' ' 68' ' ' ARG . 2.6 tmm_? -55.2 -42.12 72.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.218 -175.379 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -67.81 -33.83 75.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.304 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.486 HG22 ' HE3' ' A' ' 66' ' ' MET . 6.7 m -59.68 -49.46 77.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.1 0.476 . . . . 0.0 110.132 177.066 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.816 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -61.57 -43.92 97.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.832 178.562 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -64.07 -46.51 83.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.41 -176.742 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -62.03 -35.18 77.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.995 0.426 . . . . 0.0 110.218 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.664 HG21 ' CD1' ' A' ' 46' ' ' ILE . 78.2 mt -68.95 -47.46 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.999 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 92.9 mt -58.32 -43.56 88.23 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.594 0.712 . . . . 0.0 109.778 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -75.7 -4.08 38.34 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.74 -174.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.1 ttmt -79.3 -25.02 42.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.08 176.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 78' ' ' ARG . 16.3 mtp180 -80.71 74.78 7.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.574 0.702 . . . . 0.0 110.741 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.79 ' HB3' ' HD2' ' A' ' 80' ' ' PRO . 69.2 m -159.77 175.83 2.95 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.008 -0.996 . . . . 0.0 108.541 -177.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.79 ' HD2' ' HB3' ' A' ' 79' ' ' SER . 73.5 Cg_endo -70.25 41.9 0.36 Allowed 'Trans proline' 0 N--CA 1.482 0.804 0 C-N-CA 123.164 2.576 . . . . 0.0 112.555 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.66 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 1.5 mmp_? . . . . . 0 C--N 1.314 -0.944 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.431 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.664 0.269 . . . . 0.0 110.447 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.4 110.28 2.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.064 0.459 . . . . 0.0 111.135 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -109.17 105.92 15.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.046 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 137.59 -75.92 0.37 Allowed Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.513 -176.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.92 -33.22 75.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.16 0.505 . . . . 0.0 110.132 175.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.3 m -106.46 90.43 3.34 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 172.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tt -101.41 127.33 31.88 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.72 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -31.65 111.09 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 124.754 3.636 . . . . 0.0 113.997 176.732 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.404 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 63.0 Cg_endo -74.32 126.83 10.68 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 122.618 2.212 . . . . 0.0 111.997 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 31.8 Cg_exo -59.61 134.88 60.63 Favored 'Trans proline' 0 C--O 1.233 0.272 0 C-N-CA 122.731 2.287 . . . . 0.0 111.655 178.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 31' ' ' PRO . 42.5 Cg_exo -57.56 -48.31 17.75 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.729 2.286 . . . . 0.0 111.775 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.586 ' HA ' ' HA ' ' A' ' 38' ' ' ALA . 9.7 pt-20 -91.14 83.49 5.57 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.477 0.656 . . . . 0.0 110.385 177.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.474 ' OD1' ' HD2' ' A' ' 35' ' ' PRO . 66.1 t30 -75.13 136.68 72.59 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.333 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.474 ' HD2' ' OD1' ' A' ' 34' ' ' ASN . 5.8 Cg_exo -38.97 -37.52 0.87 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.146 3.231 . . . . 0.0 113.62 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 45.2 ttm -64.67 -52.38 57.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.236 0.541 . . . . 0.0 110.801 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.915 ' HB3' ' HB3' ' A' ' 40' ' ' ARG . 67.7 m -156.33 136.63 12.98 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 33' ' ' GLU . . . -88.97 -59.79 2.13 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.567 -178.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -84.92 -30.59 24.22 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.727 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.915 ' HB3' ' HB3' ' A' ' 37' ' ' SER . 61.1 ttt180 -62.15 -45.61 92.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.427 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.796 HG23 ' HB2' ' A' ' 37' ' ' SER . 76.6 t -66.76 -36.9 78.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.67 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.738 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.3 mtm180 -64.09 -49.23 73.04 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.643 178.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.587 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.8 -41.75 98.14 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.129 0.49 . . . . 0.0 110.082 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -57.29 -35.53 69.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.259 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.663 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.7 t60 -75.31 -37.16 60.94 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.789 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.738 HG13 ' O ' ' A' ' 42' ' ' ARG . 12.5 mt -62.76 -36.59 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.16 0.505 . . . . 0.0 110.266 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -72.05 -49.21 38.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.756 -176.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -30.26 69.85 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.736 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.969 HD13 ' HD3' ' A' ' 63' ' ' ARG . 3.1 tp -86.28 -43.15 16.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.702 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 19.2 t80 -57.21 -39.85 76.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.533 -176.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.6 -39.47 67.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.789 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.61 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 15.2 ptp -76.82 -31.28 56.81 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.911 -174.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.553 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 9.7 t -92.77 10.88 28.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.949 0.404 . . . . 0.0 110.605 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.3 t70 58.04 65.64 1.26 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 82.2 mtt180 59.41 23.15 11.67 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.309 172.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.553 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 48.8 t30 -91.82 111.45 22.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.233 0.54 . . . . 0.0 110.343 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -71.82 -27.34 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.898 -172.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 53.7 p -63.05 -50.27 71.27 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.146 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.431 ' HG3' HD11 ' A' ' 49' ' ' ILE . 13.2 tp10 -69.75 -37.67 76.52 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.074 177.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.924 HG23 HG23 ' A' ' 49' ' ' ILE . 32.5 m -55.43 -51.91 65.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.815 0.341 . . . . 0.0 110.219 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.436 ' HA ' HD23 ' A' ' 71' ' ' LEU . . . -62.43 -44.14 97.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.229 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -41.3 95.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.112 0.482 . . . . 0.0 109.949 -177.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.969 ' HD3' HD13 ' A' ' 49' ' ' ILE . 40.9 ttt85 -79.81 -13.08 59.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.079 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.579 HD21 ' HA ' ' A' ' 46' ' ' ILE . 3.0 mm? -89.57 -6.59 56.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.53 170.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.8 t30 59.89 36.43 21.83 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 122.12 0.962 . . . . 0.0 108.901 -178.133 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.741 ' SD ' ' HB ' ' A' ' 70' ' ' THR . 2.6 tmm? -140.37 157.84 44.93 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.392 -165.416 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' HIS . . . . . 0.481 ' N ' ' HG2' ' A' ' 66' ' ' MET . 0.0 OUTLIER -81.76 149.8 28.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.438 -177.788 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -24.2 67.48 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -176.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -60.63 -29.41 69.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.333 0.587 . . . . 0.0 110.111 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.741 ' HB ' ' SD ' ' A' ' 66' ' ' MET . 8.7 m -83.9 -53.09 5.84 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.173 -0.922 . . . . 0.0 110.314 176.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.855 HD21 HG22 ' A' ' 60' ' ' THR . 0.2 OUTLIER -54.61 -52.06 63.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.927 0.491 . . . . 0.0 110.879 -178.376 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.85 -46.38 89.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.592 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -65.05 -32.16 73.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.915 0.388 . . . . 0.0 111.105 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.567 HG21 ' CD1' ' A' ' 46' ' ' ILE . 82.8 mt -67.28 -46.87 82.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.694 175.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 53.1 mt -65.19 -46.87 79.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.445 0.64 . . . . 0.0 110.245 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.11 -10.48 57.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.118 -174.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.466 ' HD3' ' O ' ' A' ' 77' ' ' LYS . 7.8 tmtm? -71.21 -26.11 62.8 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -79.34 46.97 0.77 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.747 0.784 . . . . 0.0 110.187 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.522 ' HB3' ' HD2' ' A' ' 80' ' ' PRO . 49.5 m -154.07 179.22 1.36 Allowed Pre-proline 0 C--N 1.318 -0.763 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.522 ' HD2' ' HB3' ' A' ' 79' ' ' SER . 32.8 Cg_exo -60.04 -25.99 81.23 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 121.888 1.725 . . . . 0.0 111.634 174.578 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.426 ' HE ' ' C ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.776 0 CA-C-O 117.787 -1.101 . . . . 0.0 110.297 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.789 ' HB2' ' HB2' ' A' ' 26' ' ' GLU . 86.1 mt . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.9 -155.53 0.12 Allowed 'General case' 0 C--O 1.235 0.31 0 O-C-N 123.241 0.338 . . . . 0.0 111.749 -178.3 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -53.56 -39.88 65.11 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.168 0.587 . . . . 0.0 112.162 -175.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -59.88 -21.37 55.45 Favored Glycine 0 CA--C 1.519 0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 113.133 -178.847 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.789 ' HB2' ' HB2' ' A' ' 22' ' ' LEU . 10.6 tp10 -88.5 -68.15 0.79 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.4 t 179.05 164.95 0.9 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -177.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.64 133.57 86.67 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' PRO . . . . . 0.507 ' HA ' ' HD2' ' A' ' 30' ' ' PRO . 32.4 Cg_exo -30.1 112.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 124.88 3.72 . . . . 0.0 114.431 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.507 ' HD2' ' HA ' ' A' ' 29' ' ' PRO . 8.7 Cg_endo -53.09 -37.18 79.03 Favored 'Trans proline' 0 CA--C 1.551 1.353 0 C-N-CA 123.615 2.877 . . . . 0.0 115.709 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.484 ' HD3' ' HG2' ' A' ' 30' ' ' PRO . 65.6 Cg_exo -43.09 145.82 1.14 Allowed 'Trans proline' 0 C--N 1.37 1.7 0 C-N-CA 122.507 2.138 . . . . 0.0 113.765 177.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -60.7 162.59 17.91 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 123.33 2.687 . . . . 0.0 113.183 -177.168 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 66.98 -167.52 0.21 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.998 -174.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.429 ' HA ' ' HD2' ' A' ' 35' ' ' PRO . 57.2 t30 -118.62 126.44 27.16 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 176.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 34' ' ' ASN . 3.8 Cg_exo -37.54 -39.28 0.68 Allowed 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 124.457 3.438 . . . . 0.0 113.736 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' MET . . . . . 0.414 ' O ' ' HG3' ' A' ' 36' ' ' MET . 19.6 ptp -104.11 85.62 2.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.703 0.763 . . . . 0.0 110.808 177.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' SER . . . . . 0.491 ' O ' HG23 ' A' ' 41' ' ' VAL . 26.2 t -76.01 165.55 24.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 172.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.29 -37.37 86.95 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -70.38 -37.94 74.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.97 -1.014 . . . . 0.0 110.111 175.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 35' ' ' PRO . 11.3 tpt180 -64.87 -45.13 87.31 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.784 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 37' ' ' SER . 76.1 t -57.52 -42.04 80.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.879 0.371 . . . . 0.0 110.435 178.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.734 ' O ' HG13 ' A' ' 46' ' ' ILE . 24.6 mtm180 -64.35 -49.21 72.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.442 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.564 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.64 -37.06 82.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.029 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -59.68 -34.64 73.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 49' ' ' ILE . 5.1 t60 -79.99 -31.99 39.78 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.754 ' CD1' HG21 ' A' ' 74' ' ' ILE . 24.1 mt -69.09 -35.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.766 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 83.5 mm-40 -73.1 -48.8 32.64 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.021 0.439 . . . . 0.0 109.896 -177.628 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.671 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -59.81 -30.69 69.09 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.447 -178.451 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ILE . . . . . 0.877 HD13 ' HD3' ' A' ' 63' ' ' ARG . 4.1 tp -86.07 -35.81 9.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.088 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.605 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 2.2 t80 -59.86 -36.41 76.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.233 0.54 . . . . 0.0 109.716 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 47' ' ' GLN . 45.4 mt-10 -73.51 -34.04 65.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.465 175.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' MET . . . . . 0.671 ' HG2' ' O ' ' A' ' 48' ' ' ARG . 74.0 mmm -59.36 -61.26 2.76 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.068 0.461 . . . . 0.0 112.23 -176.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.609 ' HB3' ' HB3' ' A' ' 56' ' ' ASN . 6.2 t -103.36 21.24 16.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.821 -170.139 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.8 t0 56.95 72.34 0.52 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.858 175.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.578 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 78.6 mtt180 62.15 21.4 12.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.906 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASN . . . . . 0.609 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 41.0 t-20 -76.07 95.52 3.64 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 175.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.75 -34.17 61.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.097 -177.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 m -59.04 -51.54 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.59 ' OE1' ' HD2' ' A' ' 62' ' ' ARG . 6.0 tp10 -67.02 -38.68 86.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' THR . . . . . 0.857 HG22 HD21 ' A' ' 71' ' ' LEU . 30.4 m -57.39 -56.0 27.49 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.81 -178.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.566 ' HA ' HD23 ' A' ' 71' ' ' LEU . . . -55.81 -42.68 76.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.598 0.237 . . . . 0.0 110.913 178.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.59 ' HD2' ' OE1' ' A' ' 59' ' ' GLU . 0.3 OUTLIER -66.91 -44.63 80.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.105 0.479 . . . . 0.0 110.566 -177.466 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.877 ' HD3' HD13 ' A' ' 49' ' ' ILE . 12.8 ttt180 -75.38 -20.07 59.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.698 -177.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LEU . . . . . 0.748 ' HB3' ' SD ' ' A' ' 66' ' ' MET . 3.1 mm? -86.18 -11.52 52.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.711 174.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 83.1 m-20 69.66 31.64 3.55 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.102 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' MET . . . . . 0.748 ' SD ' ' HB3' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -127.24 168.4 14.78 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.863 0.839 . . . . 0.0 112.123 178.761 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -80.69 161.68 24.51 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.127 -1.397 . . . . 0.0 109.566 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 68' ' ' ARG . 19.1 tpp85 -52.02 -51.79 55.03 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.924 0.392 . . . . 0.0 111.761 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . 0.446 ' HA ' ' HD3' ' A' ' 69' ' ' ARG . 26.5 mmt180 -64.11 -28.52 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.925 -176.546 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' THR . . . . . 0.434 ' HB ' ' HB2' ' A' ' 66' ' ' MET . 3.9 m -62.36 -58.6 7.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.402 176.008 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.857 HD21 HG22 ' A' ' 60' ' ' THR . 0.2 OUTLIER -55.96 -46.23 78.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.318 -179.234 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -56.74 -46.4 81.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.319 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.4 mtm180 -69.97 -29.42 66.52 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.754 HG21 ' CD1' ' A' ' 46' ' ' ILE . 1.4 mp -71.79 -43.66 69.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.132 174.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 78.0 mt -60.8 -46.3 91.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.483 0.659 . . . . 0.0 109.439 175.153 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.84 -11.73 60.21 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.624 -175.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.632 ' HE2' ' HB3' ' A' ' 81' ' ' ARG . 14.8 tmtt? -68.95 -18.5 64.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.086 178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -77.97 39.72 0.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.103 -175.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' SER . . . . . 0.785 ' HB2' ' HD3' ' A' ' 80' ' ' PRO . 49.5 m -147.83 -54.35 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.079 177.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PRO . . . . . 0.785 ' HD3' ' HB2' ' A' ' 79' ' ' SER . 9.0 Cg_exo -72.96 -19.16 23.6 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.868 2.379 . . . . 0.0 112.496 178.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.632 ' HB3' ' HE2' ' A' ' 77' ' ' LYS . 14.1 tpt180 . . . . . 0 C--O 1.245 0.86 0 CA-C-O 118.425 -0.798 . . . . 0.0 110.717 -179.249 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 81.9 t . . . . . 0 C--O 1.236 0.373 0 CA-C-O 120.716 0.293 . . . . 0.0 110.528 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.701 ' O ' HG13 ' A' ' 46' ' ' ILE . 52.1 mtm180 -67.06 -49.47 65.02 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.528 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.616 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -58.75 -38.13 77.75 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.428 0.632 . . . . 0.0 109.834 -178.758 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.16 -30.89 71.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.716 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.754 ' O ' HG22 ' A' ' 49' ' ' ILE . 6.2 t60 -81.96 -32.0 30.95 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.718 HG23 HD21 ' A' ' 71' ' ' LEU . 11.7 mt -60.14 -37.36 72.84 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.354 177.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -74.22 -49.06 24.97 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.853 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.08 -29.45 69.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.653 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.927 HG23 HG23 ' A' ' 60' ' ' THR . 2.9 tp -85.25 -42.22 16.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.854 176.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 17.0 t80 -57.63 -31.71 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.09 0.472 . . . . 0.0 110.415 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -72.04 -48.66 42.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.39 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.522 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 24.5 ptm -74.2 -31.37 62.61 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -171.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.467 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 28.1 p -89.7 0.9 56.68 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.066 -0.396 . . . . 0.0 110.647 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.1 t70 56.3 62.1 2.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.003 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 69.9 20.52 6.63 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.055 172.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.467 ' HB3' ' HB2' ' A' ' 53' ' ' CYS . 49.7 t-20 -78.12 100.56 6.62 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 174.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 HD12 ' A' ' 71' ' ' LEU . 47.4 t -65.49 -28.86 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.313 -176.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.0 m -68.58 -48.1 65.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.824 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.423 ' HG3' HD11 ' A' ' 49' ' ' ILE . 10.2 tp10 -62.3 -42.26 99.21 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 109.82 177.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.927 HG23 HG23 ' A' ' 49' ' ' ILE . 27.9 m -59.08 -54.26 49.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.977 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.614 ' HA ' ' SD ' ' A' ' 66' ' ' MET . . . -61.32 -35.32 77.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.834 0.35 . . . . 0.0 111.667 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -74.99 -31.32 61.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.444 0.64 . . . . 0.0 109.763 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.672 ' HD3' HD13 ' A' ' 49' ' ' ILE . 46.2 ttt85 -83.28 -16.37 46.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.139 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 45' ' ' HIS . 4.1 mm? -95.35 -10.4 30.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.011 175.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 62.94 69.65 0.58 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.055 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.978 ' HG3' ' HB ' ' A' ' 70' ' ' THR . 0.1 OUTLIER -160.32 174.33 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.198 -177.507 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.57 152.58 25.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.567 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.457 ' HD2' ' O ' ' A' ' 68' ' ' ARG . 2.9 tmm_? -56.4 -37.77 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.112 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 mmt180 -61.4 -37.58 83.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.167 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.978 ' HB ' ' HG3' ' A' ' 66' ' ' MET . 5.4 m -59.87 -52.44 65.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.629 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.842 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -59.45 -45.12 92.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.588 178.418 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -59.77 -50.01 75.48 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.386 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -61.86 -38.51 88.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.7 0.286 . . . . 0.0 110.612 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.584 HG21 ' CD1' ' A' ' 46' ' ' ILE . 91.3 mt -62.06 -41.58 91.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.647 177.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 43.8 mt -70.11 -40.68 74.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.682 0.754 . . . . 0.0 110.169 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.525 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.705 -170.276 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.464 0.26 0 CA-C-O 121.658 0.742 . . . . 0.0 109.74 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.671 ' O ' HG13 ' A' ' 46' ' ' ILE . 50.4 ttp180 -76.68 -47.82 20.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.99 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.629 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -58.45 -42.17 86.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.652 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -60.11 -24.54 64.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.706 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.628 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.8 t60 -82.58 -39.64 21.98 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.728 HG12 ' HG ' ' A' ' 64' ' ' LEU . 9.6 mt -62.58 -27.76 43.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.016 177.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.41 -48.23 35.57 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.594 -174.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.576 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -71.63 -32.77 68.33 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.675 -173.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.888 HG23 HG23 ' A' ' 60' ' ' THR . 4.9 tp -82.99 -30.91 8.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.543 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.48 ' CE1' HD21 ' A' ' 75' ' ' LEU . 22.8 t80 -55.11 -40.07 70.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.362 0.601 . . . . 0.0 109.581 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.62 -30.69 61.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.123 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.619 ' HB2' HD12 ' A' ' 49' ' ' ILE . 92.8 mmm -58.44 -56.61 19.91 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.135 0.493 . . . . 0.0 111.48 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.403 ' HB2' ' HG2' ' A' ' 59' ' ' GLU . 40.7 t -97.86 3.06 49.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.946 -172.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.1 t70 67.05 80.76 0.21 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.74 -178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.466 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 47.2 mtp180 63.74 13.99 7.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 167.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -83.21 112.25 19.69 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.208 0.527 . . . . 0.0 110.79 176.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.93 -35.59 75.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.779 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 m -60.0 -50.24 74.51 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.186 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.642 ' HG3' HD11 ' A' ' 49' ' ' ILE . 8.4 tp10 -69.08 -37.72 78.62 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -178.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.888 HG23 HG23 ' A' ' 49' ' ' ILE . 38.3 m -54.5 -56.44 18.77 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.649 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.687 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . . . -56.5 -33.94 66.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.62 -177.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 62' ' ' ARG . 8.2 tpt180 -66.24 -30.24 70.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.229 0.538 . . . . 0.0 110.749 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.745 ' HD3' HD13 ' A' ' 49' ' ' ILE . 1.2 tpt180 -73.34 -53.08 11.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.018 -178.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.752 HD23 ' HB2' ' A' ' 66' ' ' MET . 0.0 OUTLIER -88.14 12.11 14.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.703 -175.371 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 t30 59.03 37.69 24.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 110.739 173.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.752 ' HB2' HD23 ' A' ' 64' ' ' LEU . 8.7 mtp -112.73 165.54 12.19 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.713 -175.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.423 ' HB3' ' OG1' ' A' ' 70' ' ' THR . 28.9 t60 -82.64 153.61 25.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.497 -1.229 . . . . 0.0 108.691 177.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -55.95 -47.43 77.58 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.608 0.242 . . . . 0.0 111.329 -175.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -64.15 -31.65 72.93 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.472 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.437 HG22 ' HE3' ' A' ' 66' ' ' MET . 6.6 m -60.26 -49.78 76.25 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.234 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.712 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -60.08 -46.44 89.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.378 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -58.17 -48.87 78.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.386 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -63.37 -50.06 71.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.04 0.447 . . . . 0.0 110.617 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.535 HG21 ' CD1' ' A' ' 46' ' ' ILE . 64.9 mt -58.92 -50.09 80.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.942 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.492 ' HA ' ' HH2' ' A' ' 43' ' ' TRP . 15.4 tp -61.87 -38.64 89.03 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.957 -178.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.903 -175.31 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 92.4 t . . . . . 0 C--O 1.235 0.295 0 CA-C-O 120.802 0.334 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.678 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.7 mtm180 -67.27 -48.47 67.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.314 176.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.543 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -55.85 -41.26 74.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.172 -177.64 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.57 -37.68 70.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.697 177.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.747 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.0 t60 -77.26 -35.86 54.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.678 HG13 ' O ' ' A' ' 42' ' ' ARG . 14.7 mt -63.26 -36.02 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.695 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -72.5 -49.74 30.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.01 -175.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.93 -28.63 69.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.47 -176.679 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 1.012 HG23 HG23 ' A' ' 60' ' ' THR . 3.4 tp -86.14 -41.98 15.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.192 177.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.439 ' CZ ' ' HA ' ' A' ' 55' ' ' ARG . 23.5 t80 -58.89 -32.8 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 0.0 110.379 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -72.83 -43.64 62.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.306 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.569 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 25.5 ptm -76.01 -41.23 51.67 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -173.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 28.6 p -81.43 -3.25 52.37 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.908 0.385 . . . . 0.0 110.679 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.2 t70 60.48 76.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.572 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.439 ' HA ' ' CZ ' ' A' ' 50' ' ' TYR . 64.6 mtt180 64.76 15.97 10.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.538 170.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.488 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 53.4 t-20 -85.41 97.52 10.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.022 0.439 . . . . 0.0 109.965 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 HD12 ' A' ' 71' ' ' LEU . 9.4 p -62.54 -29.7 47.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.309 -177.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.7 m -65.73 -48.93 70.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.319 -176.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.698 ' HG2' HD11 ' A' ' 49' ' ' ILE . 20.7 tt0 -74.68 -35.81 62.78 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.73 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 1.012 HG23 HG23 ' A' ' 49' ' ' ILE . 33.4 m -52.86 -42.03 64.85 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.46 -52.56 64.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.679 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -60.19 -41.5 93.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.462 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.948 ' HD3' HD13 ' A' ' 49' ' ' ILE . 0.7 OUTLIER -72.8 -18.62 61.46 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.394 -178.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 46' ' ' ILE . 2.8 mm? -93.21 -2.42 55.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.176 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.4 m120 63.68 26.54 14.58 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.687 0.756 . . . . 0.0 109.422 -176.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.486 ' HE3' HG22 ' A' ' 70' ' ' THR . 10.9 mtp -120.5 157.47 29.35 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.548 -172.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -74.67 154.24 38.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.077 174.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.412 ' HD2' ' O ' ' A' ' 68' ' ' ARG . 2.6 tmm_? -55.2 -42.12 72.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.218 -175.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -67.81 -33.83 75.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.304 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.486 HG22 ' HE3' ' A' ' 66' ' ' MET . 6.7 m -59.68 -49.46 77.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.1 0.476 . . . . 0.0 110.132 177.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.816 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -61.57 -43.92 97.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.832 178.562 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -64.07 -46.51 83.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.41 -176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -62.03 -35.18 77.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.995 0.426 . . . . 0.0 110.218 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.664 HG21 ' CD1' ' A' ' 46' ' ' ILE . 78.2 mt -68.95 -47.46 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.999 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 92.9 mt -58.32 -43.56 88.23 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.594 0.712 . . . . 0.0 109.778 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.461 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.74 -174.019 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 76.6 t . . . . . 0 C--O 1.233 0.197 0 CA-C-O 120.724 0.297 . . . . 0.0 110.67 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.738 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.3 mtm180 -64.09 -49.23 73.04 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.643 178.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.587 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.8 -41.75 98.14 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.129 0.49 . . . . 0.0 110.082 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -57.29 -35.53 69.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.259 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.663 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.7 t60 -75.31 -37.16 60.94 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.789 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.738 HG13 ' O ' ' A' ' 42' ' ' ARG . 12.5 mt -62.76 -36.59 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.16 0.505 . . . . 0.0 110.266 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -72.05 -49.21 38.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.756 -176.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -30.26 69.85 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.736 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.969 HD13 ' HD3' ' A' ' 63' ' ' ARG . 3.1 tp -86.28 -43.15 16.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.702 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 19.2 t80 -57.21 -39.85 76.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.533 -176.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.6 -39.47 67.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.789 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.61 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 15.2 ptp -76.82 -31.28 56.81 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.911 -174.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.553 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 9.7 t -92.77 10.88 28.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.949 0.404 . . . . 0.0 110.605 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.3 t70 58.04 65.64 1.26 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 82.2 mtt180 59.41 23.15 11.67 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.309 172.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.553 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 48.8 t30 -91.82 111.45 22.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.233 0.54 . . . . 0.0 110.343 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -71.82 -27.34 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.898 -172.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 53.7 p -63.05 -50.27 71.27 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.146 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.431 ' HG3' HD11 ' A' ' 49' ' ' ILE . 13.2 tp10 -69.75 -37.67 76.52 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.074 177.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.924 HG23 HG23 ' A' ' 49' ' ' ILE . 32.5 m -55.43 -51.91 65.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.815 0.341 . . . . 0.0 110.219 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.436 ' HA ' HD23 ' A' ' 71' ' ' LEU . . . -62.43 -44.14 97.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.229 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -41.3 95.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.112 0.482 . . . . 0.0 109.949 -177.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.969 ' HD3' HD13 ' A' ' 49' ' ' ILE . 40.9 ttt85 -79.81 -13.08 59.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.079 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.579 HD21 ' HA ' ' A' ' 46' ' ' ILE . 3.0 mm? -89.57 -6.59 56.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.53 170.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.8 t30 59.89 36.43 21.83 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 122.12 0.962 . . . . 0.0 108.901 -178.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.741 ' SD ' ' HB ' ' A' ' 70' ' ' THR . 2.6 tmm? -140.37 157.84 44.93 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.392 -165.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . 0.481 ' N ' ' HG2' ' A' ' 66' ' ' MET . 0.0 OUTLIER -81.76 149.8 28.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.438 -177.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -24.2 67.48 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -176.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -60.63 -29.41 69.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.333 0.587 . . . . 0.0 110.111 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.741 ' HB ' ' SD ' ' A' ' 66' ' ' MET . 8.7 m -83.9 -53.09 5.84 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.173 -0.922 . . . . 0.0 110.314 176.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.855 HD21 HG22 ' A' ' 60' ' ' THR . 0.2 OUTLIER -54.61 -52.06 63.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.927 0.491 . . . . 0.0 110.879 -178.376 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.85 -46.38 89.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.592 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -65.05 -32.16 73.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.915 0.388 . . . . 0.0 111.105 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.567 HG21 ' CD1' ' A' ' 46' ' ' ILE . 82.8 mt -67.28 -46.87 82.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.694 175.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 53.1 mt -65.19 -46.87 79.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.445 0.64 . . . . 0.0 110.245 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.118 -174.25 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 76.1 t . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.879 0.371 . . . . 0.0 110.435 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.734 ' O ' HG13 ' A' ' 46' ' ' ILE . 24.6 mtm180 -64.35 -49.21 72.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.442 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.564 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.64 -37.06 82.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.029 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -59.68 -34.64 73.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 49' ' ' ILE . 5.1 t60 -79.99 -31.99 39.78 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.754 ' CD1' HG21 ' A' ' 74' ' ' ILE . 24.1 mt -69.09 -35.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.766 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 83.5 mm-40 -73.1 -48.8 32.64 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.021 0.439 . . . . 0.0 109.896 -177.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.671 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -59.81 -30.69 69.09 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.447 -178.451 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ILE . . . . . 0.877 HD13 ' HD3' ' A' ' 63' ' ' ARG . 4.1 tp -86.07 -35.81 9.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.088 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.605 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 2.2 t80 -59.86 -36.41 76.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.233 0.54 . . . . 0.0 109.716 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 47' ' ' GLN . 45.4 mt-10 -73.51 -34.04 65.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.465 175.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' MET . . . . . 0.671 ' HG2' ' O ' ' A' ' 48' ' ' ARG . 74.0 mmm -59.36 -61.26 2.76 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.068 0.461 . . . . 0.0 112.23 -176.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.609 ' HB3' ' HB3' ' A' ' 56' ' ' ASN . 6.2 t -103.36 21.24 16.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.821 -170.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.8 t0 56.95 72.34 0.52 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.858 175.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.578 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 78.6 mtt180 62.15 21.4 12.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.906 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . 0.609 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 41.0 t-20 -76.07 95.52 3.64 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 175.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.75 -34.17 61.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.097 -177.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 m -59.04 -51.54 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.59 ' OE1' ' HD2' ' A' ' 62' ' ' ARG . 6.0 tp10 -67.02 -38.68 86.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' THR . . . . . 0.857 HG22 HD21 ' A' ' 71' ' ' LEU . 30.4 m -57.39 -56.0 27.49 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.81 -178.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.566 ' HA ' HD23 ' A' ' 71' ' ' LEU . . . -55.81 -42.68 76.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.598 0.237 . . . . 0.0 110.913 178.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.59 ' HD2' ' OE1' ' A' ' 59' ' ' GLU . 0.3 OUTLIER -66.91 -44.63 80.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.105 0.479 . . . . 0.0 110.566 -177.466 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.877 ' HD3' HD13 ' A' ' 49' ' ' ILE . 12.8 ttt180 -75.38 -20.07 59.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.698 -177.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' LEU . . . . . 0.748 ' HB3' ' SD ' ' A' ' 66' ' ' MET . 3.1 mm? -86.18 -11.52 52.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.711 174.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.4 m120 69.66 31.64 3.55 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.102 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' MET . . . . . 0.748 ' SD ' ' HB3' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -127.24 168.4 14.78 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.863 0.839 . . . . 0.0 112.123 178.761 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -80.69 161.68 24.51 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.127 -1.397 . . . . 0.0 109.566 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 68' ' ' ARG . 19.1 tpp85 -52.02 -51.79 55.03 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.924 0.392 . . . . 0.0 111.761 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . 0.446 ' HA ' ' HD3' ' A' ' 69' ' ' ARG . 26.5 mmt180 -64.11 -28.52 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.925 -176.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' THR . . . . . 0.434 ' HB ' ' HB2' ' A' ' 66' ' ' MET . 3.9 m -62.36 -58.6 7.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.402 176.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.857 HD21 HG22 ' A' ' 60' ' ' THR . 0.2 OUTLIER -55.96 -46.23 78.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.318 -179.234 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -56.74 -46.4 81.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.319 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.4 mtm180 -69.97 -29.42 66.52 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.754 HG21 ' CD1' ' A' ' 46' ' ' ILE . 1.4 mp -71.79 -43.66 69.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.132 174.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 78.0 mt -60.8 -46.3 91.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.483 0.659 . . . . 0.0 109.439 175.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.287 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.624 -175.668 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.51 ' O ' HD12 ' A' ' 22' ' ' LEU . 3.1 pp . . . . . 0 N--CA 1.48 1.053 0 CA-C-O 120.589 0.233 . . . . 0.0 110.632 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 61.69 177.7 0.12 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.997 -179.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 52.8 mtpt -136.38 -162.91 1.33 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.184 176.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 73.68 -107.74 2.32 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.974 178.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -96.12 -7.11 36.85 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 120.9 0.381 . . . . 0.0 110.762 -176.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.5 m -80.89 -15.0 57.5 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.865 179.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.417 ' HA ' ' HD2' ' A' ' 29' ' ' PRO . 3.2 tt -132.22 95.75 20.84 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 109.209 -0.663 . . . . 0.0 109.209 178.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.453 ' HA ' ' HD3' ' A' ' 30' ' ' PRO . 40.9 Cg_exo -32.32 119.84 0.09 OUTLIER 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 125.119 3.879 . . . . 0.0 114.82 179.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.495 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 1.7 Cg_endo -85.08 132.02 4.45 Favored 'Trans proline' 0 N--CA 1.455 -0.746 0 C-N-CA 123.406 2.737 . . . . 0.0 111.664 174.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.495 ' HD3' ' HA ' ' A' ' 30' ' ' PRO . 18.7 Cg_exo -67.5 172.87 9.67 Favored 'Trans proline' 0 CA--C 1.533 0.455 0 C-N-CA 122.951 2.434 . . . . 0.0 111.562 176.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -70.89 55.06 1.7 Allowed 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 122.812 2.342 . . . . 0.0 112.268 175.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -62.75 -35.3 79.33 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.202 -177.747 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.407 ' HA ' ' HD2' ' A' ' 35' ' ' PRO . 14.3 m120 -87.17 134.3 36.93 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.717 -176.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.407 ' HD2' ' HA ' ' A' ' 34' ' ' ASN . 5.2 Cg_endo -48.68 -48.09 18.75 Favored 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 123.545 2.83 . . . . 0.0 112.198 174.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 67.0 mtt -86.91 74.4 9.75 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.601 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.666 ' HB3' ' HB2' ' A' ' 40' ' ' ARG . 25.0 t -73.03 161.94 30.07 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.581 176.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -64.19 -41.8 96.92 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-O 121.073 0.463 . . . . 0.0 110.603 -172.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -87.49 -26.79 23.02 Favored 'General case' 0 N--CA 1.445 -0.682 0 C-N-CA 120.276 -0.569 . . . . 0.0 109.982 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.666 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 3.7 tmt_? -59.88 -44.08 94.39 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.737 179.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 37' ' ' SER . 81.9 t -60.64 -35.89 66.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.528 177.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.701 ' O ' HG13 ' A' ' 46' ' ' ILE . 52.1 mtm180 -67.06 -49.47 65.02 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.528 -179.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.676 ' HZ2' ' HG2' ' A' ' 78' ' ' ARG . 0.0 OUTLIER -58.75 -38.13 77.75 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.428 0.632 . . . . 0.0 109.834 -178.758 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 42.9 tt0 -63.16 -30.89 71.95 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.716 178.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.754 ' O ' HG22 ' A' ' 49' ' ' ILE . 6.2 t60 -81.96 -32.0 30.95 Favored 'General case' 0 N--CA 1.442 -0.873 0 N-CA-C 108.069 -1.085 . . . . 0.0 108.069 -175.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.718 HG23 HD21 ' A' ' 71' ' ' LEU . 11.7 mt -60.14 -37.36 72.84 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.195 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.354 177.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 75.8 mm-40 -74.22 -49.06 24.97 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.853 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.469 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.08 -29.45 69.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.653 -177.658 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.927 HG23 HG23 ' A' ' 60' ' ' THR . 2.9 tp -85.25 -42.22 16.16 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.854 176.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 17.0 t80 -57.63 -31.71 66.53 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.09 0.472 . . . . 0.0 110.415 -178.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -72.04 -48.66 42.85 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.39 176.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.522 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 24.5 ptm -74.2 -31.37 62.61 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -171.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.467 ' HB2' ' HB3' ' A' ' 56' ' ' ASN . 28.1 p -89.7 0.9 56.68 Favored 'General case' 0 C--N 1.327 -0.382 0 O-C-N 122.066 -0.396 . . . . 0.0 110.647 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.1 t70 56.3 62.1 2.46 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.564 -0.744 . . . . 0.0 111.003 -178.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 36.0 mtm180 69.9 20.52 6.63 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 115.047 -0.979 . . . . 0.0 113.055 172.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.467 ' HB3' ' HB2' ' A' ' 53' ' ' CYS . 49.7 t-20 -78.12 100.56 6.62 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 174.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.464 HG13 HD12 ' A' ' 71' ' ' LEU . 47.4 t -65.49 -28.86 45.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.462 0 CA-C-N 115.83 -0.623 . . . . 0.0 111.313 -176.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 33.0 m -68.58 -48.1 65.06 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.481 -0.327 . . . . 0.0 110.824 -179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.423 ' HG3' HD11 ' A' ' 49' ' ' ILE . 10.2 tp10 -62.3 -42.26 99.21 Favored 'General case' 0 CA--C 1.516 -0.357 0 CA-C-O 121.022 0.439 . . . . 0.0 109.82 177.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.927 HG23 HG23 ' A' ' 49' ' ' ILE . 27.9 m -59.08 -54.26 49.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.618 -0.719 . . . . 0.0 110.977 -178.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.614 ' HA ' ' SD ' ' A' ' 66' ' ' MET . . . -61.32 -35.32 77.05 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.834 0.35 . . . . 0.0 111.667 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 5.9 tpm_? -74.99 -31.32 61.41 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.444 0.64 . . . . 0.0 109.763 -178.308 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.672 ' HD3' HD13 ' A' ' 49' ' ' ILE . 46.2 ttt85 -83.28 -16.37 46.56 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.139 -179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 45' ' ' HIS . 4.1 mm? -95.35 -10.4 30.21 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.274 -0.876 . . . . 0.0 110.011 175.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 62.94 69.65 0.58 Allowed 'General case' 0 C--O 1.235 0.334 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.055 -175.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.978 ' HG3' ' HB ' ' A' ' 70' ' ' THR . 0.1 OUTLIER -160.32 174.33 14.33 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.198 -177.507 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -82.57 152.58 25.9 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.198 -0.91 . . . . 0.0 109.567 178.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.457 ' HD2' ' O ' ' A' ' 68' ' ' ARG . 2.9 tmm_? -56.4 -37.77 70.62 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.81 0.338 . . . . 0.0 110.112 -178.186 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 22.9 mmt180 -61.4 -37.58 83.97 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.976 -0.556 . . . . 0.0 111.167 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.978 ' HB ' ' HG3' ' A' ' 66' ' ' MET . 5.4 m -59.87 -52.44 65.44 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.42 -0.354 . . . . 0.0 110.629 179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.842 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -59.45 -45.12 92.51 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.903 -0.589 . . . . 0.0 109.588 178.418 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 63.7 tt0 -59.77 -50.01 75.48 Favored 'General case' 0 CA--C 1.516 -0.337 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.386 -178.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 18.6 tpp180 -61.86 -38.51 88.53 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.7 0.286 . . . . 0.0 110.612 -178.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.584 HG21 ' CD1' ' A' ' 46' ' ' ILE . 91.3 mt -62.06 -41.58 91.66 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.453 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.647 177.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.589 ' HB3' HH21 ' A' ' 81' ' ' ARG . 43.8 mt -70.11 -40.68 74.76 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.682 0.754 . . . . 0.0 110.169 175.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.03 -22.39 59.59 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 114.888 -1.051 . . . . 0.0 112.705 -170.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.86 -13.08 58.1 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.667 -0.413 . . . . 0.0 111.792 176.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.676 ' HG2' ' HZ2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -113.2 4.05 16.32 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.022 0.439 . . . . 0.0 111.106 -179.177 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 46.1 m -149.26 154.65 39.16 Favored Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.177 178.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -77.8 29.82 0.44 Allowed 'Trans proline' 0 CA--C 1.531 0.343 0 C-N-CA 122.767 2.311 . . . . 0.0 112.317 178.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.589 HH21 ' HB3' ' A' ' 75' ' ' LEU . 56.2 ttp180 . . . . . 0 C--O 1.244 0.79 0 CA-C-O 118.264 -0.874 . . . . 0.0 110.376 -176.249 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.821 HD11 ' HA ' ' A' ' 28' ' ' LEU . 2.4 pt? . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -63.91 141.26 58.83 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 120.991 0.424 . . . . 0.0 111.245 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -85.79 133.67 33.97 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.457 -179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 81.43 -3.53 77.53 Favored Glycine 0 N--CA 1.451 -0.362 0 C-N-CA 120.802 -0.713 . . . . 0.0 112.345 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -102.05 26.23 7.86 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 120.854 0.359 . . . . 0.0 110.729 -179.177 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.9 t 74.25 117.25 0.05 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 114.919 -1.037 . . . . 0.0 111.734 175.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.821 ' HA ' HD11 ' A' ' 22' ' ' LEU . 7.1 mp -79.16 159.02 73.81 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 115.446 -0.797 . . . . 0.0 108.902 174.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.484 ' HA ' ' HD3' ' A' ' 30' ' ' PRO . 35.6 Cg_exo -30.18 106.05 0.03 OUTLIER 'Trans proline' 0 C--N 1.355 0.891 0 C-N-CA 124.53 3.487 . . . . 0.0 113.816 179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.484 ' HD3' ' HA ' ' A' ' 29' ' ' PRO . 8.1 Cg_exo -72.76 118.38 5.55 Favored 'Trans proline' 0 N--CA 1.463 -0.29 0 C-N-CA 123.227 2.618 . . . . 0.0 112.972 -174.328 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_exo -56.87 -41.07 79.4 Favored 'Trans proline' 0 CA--C 1.543 0.955 0 C-N-CA 123.052 2.502 . . . . 0.0 113.517 171.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_exo -53.85 118.09 4.58 Favored 'Trans proline' 0 C--N 1.366 1.491 0 C-N-CA 121.731 1.621 . . . . 0.0 111.408 171.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 61.88 -117.39 0.63 Allowed 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.408 -169.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -153.59 150.73 23.87 Favored Pre-proline 0 C--N 1.325 -0.484 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_endo -50.69 -31.28 31.8 Favored 'Trans proline' 0 N--CA 1.46 -0.449 0 C-N-CA 123.102 2.535 . . . . 0.0 111.854 171.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.453 ' O ' ' HB3' ' A' ' 37' ' ' SER . 48.0 tpp -97.94 17.23 18.71 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.222 179.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 1.06 ' HB3' ' HB2' ' A' ' 40' ' ' ARG . 38.0 t 71.47 142.84 0.06 Allowed 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.307 0.643 . . . . 0.0 110.689 -174.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -72.91 -31.58 64.74 Favored 'General case' 0 CA--C 1.515 -0.387 0 CA-C-O 121.178 0.514 . . . . 0.0 109.65 178.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -78.82 -46.17 19.29 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.953 178.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 1.06 ' HB2' ' HB3' ' A' ' 37' ' ' SER . 7.6 mmm180 -66.87 -40.7 87.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.924 -177.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 5.0 p -64.15 -29.86 48.49 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.658 0.742 . . . . 0.0 109.74 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.671 ' O ' HG13 ' A' ' 46' ' ' ILE . 50.4 ttp180 -76.68 -47.82 20.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 114.907 -1.042 . . . . 0.0 109.99 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.629 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -58.45 -42.17 86.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.549 -0.751 . . . . 0.0 110.652 178.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -60.11 -24.54 64.73 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.706 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.628 ' O ' HG22 ' A' ' 49' ' ' ILE . 4.8 t60 -82.58 -39.64 21.98 Favored 'General case' 0 N--CA 1.444 -0.731 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -178.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.728 HG12 ' HG ' ' A' ' 64' ' ' LEU . 9.6 mt -62.58 -27.76 43.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 CA-C-N 114.079 -1.419 . . . . 0.0 110.016 177.835 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.41 -48.23 35.57 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 114.865 -1.061 . . . . 0.0 109.594 -174.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.576 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -71.63 -32.77 68.33 Favored 'General case' 0 N--CA 1.448 -0.544 0 CA-C-N 114.603 -1.181 . . . . 0.0 111.675 -173.177 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.888 HG23 HG23 ' A' ' 60' ' ' THR . 4.9 tp -82.99 -30.91 8.59 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 C-N-CA 120.82 -0.352 . . . . 0.0 111.543 -176.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.48 ' CE1' HD21 ' A' ' 75' ' ' LEU . 22.8 t80 -55.11 -40.07 70.07 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.362 0.601 . . . . 0.0 109.581 178.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -74.62 -30.69 61.75 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.123 179.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.619 ' HB2' HD12 ' A' ' 49' ' ' ILE . 92.8 mmm -58.44 -56.61 19.91 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.135 0.493 . . . . 0.0 111.48 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.403 ' HB2' ' HG2' ' A' ' 59' ' ' GLU . 40.7 t -97.86 3.06 49.86 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.946 -172.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 33.1 t70 67.05 80.76 0.21 Allowed 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.74 -178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.466 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 47.2 mtp180 63.74 13.99 7.87 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 113.688 0.996 . . . . 0.0 113.688 167.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -83.21 112.25 19.69 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.208 0.527 . . . . 0.0 110.79 176.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.0 t -64.93 -35.59 75.7 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.779 -177.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.4 m -60.0 -50.24 74.51 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.186 -178.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.642 ' HG3' HD11 ' A' ' 49' ' ' ILE . 8.4 tp10 -69.08 -37.72 78.62 Favored 'General case' 0 CA--C 1.518 -0.282 0 N-CA-C 110.08 -0.341 . . . . 0.0 110.08 -178.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.888 HG23 HG23 ' A' ' 49' ' ' ILE . 38.3 m -54.5 -56.44 18.77 Favored 'General case' 0 N--CA 1.445 -0.705 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.649 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.687 ' HA ' ' CD2' ' A' ' 64' ' ' LEU . . . -56.5 -33.94 66.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.62 -177.547 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 62' ' ' ARG . 8.2 tpt180 -66.24 -30.24 70.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.229 0.538 . . . . 0.0 110.749 178.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.745 ' HD3' HD13 ' A' ' 49' ' ' ILE . 1.2 tpt180 -73.34 -53.08 11.65 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.708 -0.678 . . . . 0.0 111.018 -178.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.752 HD23 ' HB2' ' A' ' 66' ' ' MET . 0.0 OUTLIER -88.14 12.11 14.51 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.703 -175.371 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 3.1 t30 59.03 37.69 24.32 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 110.739 173.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.752 ' HB2' HD23 ' A' ' 64' ' ' LEU . 8.7 mtp -112.73 165.54 12.19 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.409 -0.814 . . . . 0.0 111.713 -175.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.423 ' HB3' ' OG1' ' A' ' 70' ' ' THR . 28.9 t60 -82.64 153.61 25.32 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 114.497 -1.229 . . . . 0.0 108.691 177.569 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 8.1 tpp180 -55.95 -47.43 77.58 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.608 0.242 . . . . 0.0 111.329 -175.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 84.3 mtt180 -64.15 -31.65 72.93 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 116.514 -0.312 . . . . 0.0 111.472 178.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.437 HG22 ' HE3' ' A' ' 66' ' ' MET . 6.6 m -60.26 -49.78 76.25 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.234 176.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.712 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -60.08 -46.44 89.56 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.681 178.378 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 62.5 tp60 -58.17 -48.87 78.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.386 -173.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -63.37 -50.06 71.4 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.04 0.447 . . . . 0.0 110.617 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.535 HG21 ' CD1' ' A' ' 46' ' ' ILE . 64.9 mt -58.92 -50.09 80.79 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 CA-C-N 115.411 -0.813 . . . . 0.0 110.942 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.492 ' HA ' ' HH2' ' A' ' 43' ' ' TRP . 15.4 tp -61.87 -38.64 89.03 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.957 -178.099 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -81.22 -18.04 47.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.903 -175.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.0 tmtt? -78.46 -17.83 55.74 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.927 -172.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.3 mtm180 -48.27 97.03 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -171.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.51 ' HB3' ' HD2' ' A' ' 80' ' ' PRO . 67.1 m -162.15 166.05 14.82 Favored Pre-proline 0 C--N 1.324 -0.54 0 CA-C-N 114.853 -1.067 . . . . 0.0 108.469 175.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.51 ' HD2' ' HB3' ' A' ' 79' ' ' SER . 71.9 Cg_endo -71.94 34.48 0.29 Allowed 'Trans proline' 0 N--CA 1.477 0.541 0 C-N-CA 122.977 2.451 . . . . 0.0 112.01 175.436 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.471 ' H ' ' C ' ' A' ' 79' ' ' SER . 57.8 ttt180 . . . . . 0 C--O 1.244 0.784 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.875 -177.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.406 ' O ' HD13 ' A' ' 22' ' ' LEU . 1.7 tm? . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 120.706 0.288 . . . . 0.0 110.368 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -73.31 148.35 43.6 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.752 0.31 . . . . 0.0 111.524 -175.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 47.8 mttp -69.19 -23.94 63.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.325 175.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -78.13 24.01 2.57 Favored Glycine 0 N--CA 1.451 -0.304 0 CA-C-N 115.905 -0.589 . . . . 0.0 112.167 176.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 15.9 tp10 -65.49 -46.24 80.52 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.495 0.664 . . . . 0.0 109.611 176.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.1 m -156.19 -37.18 0.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.069 -0.969 . . . . 0.0 109.663 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.484 HD12 ' HD2' ' A' ' 29' ' ' PRO . 43.3 tp 67.81 107.56 0.03 OUTLIER Pre-proline 0 C--N 1.341 0.212 0 O-C-N 124.136 0.897 . . . . 0.0 110.134 -176.723 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.484 ' HD2' HD12 ' A' ' 28' ' ' LEU . 33.6 Cg_exo -26.9 103.68 0.02 OUTLIER 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 125.177 3.918 . . . . 0.0 114.246 -176.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.664 ' HG2' ' HD3' ' A' ' 31' ' ' PRO . 1.7 Cg_endo -47.09 -47.96 15.73 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 123.361 2.708 . . . . 0.0 114.363 -178.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.664 ' HD3' ' HG2' ' A' ' 30' ' ' PRO . 6.1 Cg_exo -79.1 116.47 3.68 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 121.773 1.649 . . . . 0.0 111.637 176.283 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -69.13 -31.56 23.07 Favored 'Trans proline' 0 N--CA 1.463 -0.267 0 C-N-CA 122.433 2.089 . . . . 0.0 111.539 178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -165.92 149.47 7.76 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.301 -0.863 . . . . 0.0 109.483 177.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.6 ' HB2' ' HD2' ' A' ' 35' ' ' PRO . 21.1 p30 -130.78 174.66 4.41 Favored Pre-proline 0 C--N 1.32 -0.679 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 -176.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.6 ' HD2' ' HB2' ' A' ' 34' ' ' ASN . 6.0 Cg_exo -40.67 -42.15 4.02 Favored 'Trans proline' 0 C--N 1.351 0.694 0 C-N-CA 124.01 3.14 . . . . 0.0 113.886 173.383 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.707 ' O ' ' HB2' ' A' ' 40' ' ' ARG . 33.1 mmm -82.35 -3.06 54.73 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -178.378 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.49 ' O ' HG23 ' A' ' 41' ' ' VAL . 45.7 m 65.8 125.42 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 C-N-CA 123.043 0.537 . . . . 0.0 111.25 -176.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -61.51 -29.63 70.11 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.433 0.635 . . . . 0.0 109.449 179.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -74.13 -43.37 57.77 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.425 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.707 ' HB2' ' O ' ' A' ' 36' ' ' MET . 59.6 mtp180 -67.87 -34.42 76.63 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.652 -178.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.49 HG23 ' O ' ' A' ' 37' ' ' SER . 92.4 t -58.45 -42.2 83.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.295 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.107 173.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.678 ' O ' HG13 ' A' ' 46' ' ' ILE . 65.7 mtm180 -67.27 -48.47 67.62 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.314 176.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.543 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -55.85 -41.26 74.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.172 -177.64 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -56.57 -37.68 70.92 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.174 -0.467 . . . . 0.0 110.697 177.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.747 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.0 t60 -77.26 -35.86 54.9 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.678 HG13 ' O ' ' A' ' 42' ' ' ARG . 14.7 mt -63.26 -36.02 74.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.695 179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 76.9 mm-40 -72.5 -49.74 30.84 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.01 -175.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 45' ' ' HIS . 0.0 OUTLIER -61.93 -28.63 69.67 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.597 -0.729 . . . . 0.0 111.47 -176.679 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 1.012 HG23 HG23 ' A' ' 60' ' ' THR . 3.4 tp -86.14 -41.98 15.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 C-N-CA 120.265 -0.574 . . . . 0.0 111.192 177.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.439 ' CZ ' ' HA ' ' A' ' 55' ' ' ARG . 23.5 t80 -58.89 -32.8 69.84 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.069 0.461 . . . . 0.0 110.379 -178.655 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 22.8 mm-40 -72.83 -43.64 62.41 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.306 176.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.569 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 25.5 ptm -76.01 -41.23 51.67 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 112.111 0.411 . . . . 0.0 112.111 -173.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.488 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 28.6 p -81.43 -3.25 52.37 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 120.908 0.385 . . . . 0.0 110.679 178.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 20.2 t70 60.48 76.89 0.35 Allowed 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.572 179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.439 ' HA ' ' CZ ' ' A' ' 50' ' ' TYR . 64.6 mtt180 64.76 15.97 10.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.374 -0.83 . . . . 0.0 112.538 170.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.488 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 53.4 t-20 -85.41 97.52 10.05 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.022 0.439 . . . . 0.0 109.965 179.65 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.424 HG23 HD12 ' A' ' 71' ' ' LEU . 9.4 p -62.54 -29.7 47.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 116.033 -0.53 . . . . 0.0 111.309 -177.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 19.7 m -65.73 -48.93 70.27 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.319 -176.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.698 ' HG2' HD11 ' A' ' 49' ' ' ILE . 20.7 tt0 -74.68 -35.81 62.78 Favored 'General case' 0 CA--C 1.512 -0.496 0 C-N-CA 120.21 -0.596 . . . . 0.0 110.73 -179.616 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 1.012 HG23 HG23 ' A' ' 49' ' ' ILE . 33.4 m -52.86 -42.03 64.85 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.46 -52.56 64.02 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.679 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 20.7 tpt180 -60.19 -41.5 93.07 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.462 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.948 ' HD3' HD13 ' A' ' 49' ' ' ILE . 0.7 OUTLIER -72.8 -18.62 61.46 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.394 -178.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.594 HD21 ' HA ' ' A' ' 46' ' ' ILE . 2.8 mm? -93.21 -2.42 55.21 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.176 178.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.4 m120 63.68 26.54 14.58 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-O 121.687 0.756 . . . . 0.0 109.422 -176.267 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.486 ' HE3' HG22 ' A' ' 70' ' ' THR . 10.9 mtp -120.5 157.47 29.35 Favored 'General case' 0 CA--C 1.509 -0.599 0 CA-C-N 114.808 -1.087 . . . . 0.0 111.548 -172.083 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 49.7 t60 -74.67 154.24 38.56 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 114.603 -1.18 . . . . 0.0 109.077 174.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.412 ' HD2' ' O ' ' A' ' 68' ' ' ARG . 2.6 tmm_? -55.2 -42.12 72.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.73 0.3 . . . . 0.0 111.218 -175.379 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 26.0 ttm180 -67.81 -33.83 75.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.545 -0.298 . . . . 0.0 111.304 -178.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.486 HG22 ' HE3' ' A' ' 66' ' ' MET . 6.7 m -59.68 -49.46 77.66 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.1 0.476 . . . . 0.0 110.132 177.066 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.816 HD21 HG22 ' A' ' 60' ' ' THR . 0.3 OUTLIER -61.57 -43.92 97.98 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.832 178.562 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -64.07 -46.51 83.98 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.331 -0.85 . . . . 0.0 111.41 -176.742 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -62.03 -35.18 77.8 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.995 0.426 . . . . 0.0 110.218 179.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.664 HG21 ' CD1' ' A' ' 46' ' ' ILE . 78.2 mt -68.95 -47.46 75.62 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.999 177.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 92.9 mt -58.32 -43.56 88.23 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-O 121.594 0.712 . . . . 0.0 109.778 175.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -75.7 -4.08 38.34 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 114.677 -1.147 . . . . 0.0 111.74 -174.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.1 ttmt -79.3 -25.02 42.46 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.08 176.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 78' ' ' ARG . 16.3 mtp180 -80.71 74.78 7.63 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.574 0.702 . . . . 0.0 110.741 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.79 ' HB3' ' HD2' ' A' ' 80' ' ' PRO . 69.2 m -159.77 175.83 2.95 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.008 -0.996 . . . . 0.0 108.541 -177.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.79 ' HD2' ' HB3' ' A' ' 79' ' ' SER . 73.5 Cg_endo -70.25 41.9 0.36 Allowed 'Trans proline' 0 N--CA 1.482 0.804 0 C-N-CA 123.164 2.576 . . . . 0.0 112.555 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.66 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 1.5 mmp_? . . . . . 0 C--N 1.314 -0.944 0 CA-C-O 118.554 -0.736 . . . . 0.0 110.431 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 N--CA 1.484 1.245 0 CA-C-O 120.664 0.269 . . . . 0.0 110.447 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.4 110.28 2.6 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.064 0.459 . . . . 0.0 111.135 -178.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 37.1 mtmm -109.17 105.92 15.57 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.046 179.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 137.59 -75.92 0.37 Allowed Glycine 0 N--CA 1.448 -0.506 0 CA-C-N 115.573 -0.74 . . . . 0.0 111.513 -176.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -63.92 -33.22 75.21 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 121.16 0.505 . . . . 0.0 110.132 175.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.3 m -106.46 90.43 3.34 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.163 -0.68 . . . . 0.0 109.163 172.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.5 tt -101.41 127.33 31.88 Favored Pre-proline 0 C--N 1.323 -0.575 0 CA-C-N 115.848 -0.614 . . . . 0.0 109.72 -176.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -31.65 111.09 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.752 0 C-N-CA 124.754 3.636 . . . . 0.0 113.997 176.732 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.404 ' HA ' ' HD3' ' A' ' 31' ' ' PRO . 63.0 Cg_endo -74.32 126.83 10.68 Favored 'Trans proline' 0 N--CA 1.46 -0.496 0 C-N-CA 122.618 2.212 . . . . 0.0 111.997 179.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.427 ' HA ' ' HD3' ' A' ' 32' ' ' PRO . 31.8 Cg_exo -59.61 134.88 60.63 Favored 'Trans proline' 0 C--O 1.233 0.272 0 C-N-CA 122.731 2.287 . . . . 0.0 111.655 178.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 31' ' ' PRO . 42.5 Cg_exo -57.56 -48.31 17.75 Favored 'Trans proline' 0 C--N 1.344 0.332 0 C-N-CA 122.729 2.286 . . . . 0.0 111.775 179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.586 ' HA ' ' HA ' ' A' ' 38' ' ' ALA . 9.7 pt-20 -91.14 83.49 5.57 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.477 0.656 . . . . 0.0 110.385 177.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.474 ' OD1' ' HD2' ' A' ' 35' ' ' PRO . 66.1 t30 -75.13 136.68 72.59 Favored Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.333 179.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.474 ' HD2' ' OD1' ' A' ' 34' ' ' ASN . 5.8 Cg_exo -38.97 -37.52 0.87 Allowed 'Trans proline' 0 CA--C 1.534 0.491 0 C-N-CA 124.146 3.231 . . . . 0.0 113.62 175.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 45.2 ttm -64.67 -52.38 57.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.236 0.541 . . . . 0.0 110.801 178.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.915 ' HB3' ' HB3' ' A' ' 40' ' ' ARG . 67.7 m -156.33 136.63 12.98 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 -179.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.586 ' HA ' ' HA ' ' A' ' 33' ' ' GLU . . . -88.97 -59.79 2.13 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.351 -0.54 . . . . 0.0 110.567 -178.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -84.92 -30.59 24.22 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.727 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.915 ' HB3' ' HB3' ' A' ' 37' ' ' SER . 61.1 ttt180 -62.15 -45.61 92.66 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.427 179.353 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.796 HG23 ' HB2' ' A' ' 37' ' ' SER . 76.6 t -66.76 -36.9 78.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.67 179.518 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.738 ' O ' HG13 ' A' ' 46' ' ' ILE . 57.3 mtm180 -64.09 -49.23 73.04 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.643 178.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.587 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.8 -41.75 98.14 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 121.129 0.49 . . . . 0.0 110.082 -179.252 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -57.29 -35.53 69.92 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.259 177.194 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.663 ' O ' HG22 ' A' ' 49' ' ' ILE . 3.7 t60 -75.31 -37.16 60.94 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 115.923 -0.581 . . . . 0.0 109.789 -179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.738 HG13 ' O ' ' A' ' 42' ' ' ARG . 12.5 mt -62.76 -36.59 76.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 121.16 0.505 . . . . 0.0 110.266 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 -72.05 -49.21 38.45 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.756 -176.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -60.71 -30.26 69.85 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.736 -178.102 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.969 HD13 ' HD3' ' A' ' 63' ' ' ARG . 3.1 tp -86.28 -43.15 16.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 C-N-CA 120.604 -0.438 . . . . 0.0 111.702 178.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 19.2 t80 -57.21 -39.85 76.26 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.169 0.509 . . . . 0.0 110.533 -176.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -72.6 -39.47 67.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.764 -0.653 . . . . 0.0 111.789 -179.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.61 ' HG2' ' HA ' ' A' ' 49' ' ' ILE . 15.2 ptp -76.82 -31.28 56.81 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 120.639 -0.424 . . . . 0.0 111.911 -174.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.553 ' SG ' ' HB3' ' A' ' 56' ' ' ASN . 9.7 t -92.77 10.88 28.95 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.949 0.404 . . . . 0.0 110.605 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 30.3 t70 58.04 65.64 1.26 Allowed 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.452 176.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 82.2 mtt180 59.41 23.15 11.67 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.309 172.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.553 ' HB3' ' SG ' ' A' ' 53' ' ' CYS . 48.8 t30 -91.82 111.45 22.98 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.233 0.54 . . . . 0.0 110.343 178.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -71.82 -27.34 27.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.578 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.898 -172.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 53.7 p -63.05 -50.27 71.27 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 120.976 -0.29 . . . . 0.0 111.146 -176.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.431 ' HG3' HD11 ' A' ' 49' ' ' ILE . 13.2 tp10 -69.75 -37.67 76.52 Favored 'General case' 0 CA--C 1.514 -0.409 0 C-N-CA 120.715 -0.394 . . . . 0.0 110.074 177.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.924 HG23 HG23 ' A' ' 49' ' ' ILE . 32.5 m -55.43 -51.91 65.32 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 120.815 0.341 . . . . 0.0 110.219 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.436 ' HA ' HD23 ' A' ' 71' ' ' LEU . . . -62.43 -44.14 97.15 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.229 179.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -65.09 -41.3 95.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.112 0.482 . . . . 0.0 109.949 -177.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.969 ' HD3' HD13 ' A' ' 49' ' ' ILE . 40.9 ttt85 -79.81 -13.08 59.68 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.079 -177.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.579 HD21 ' HA ' ' A' ' 46' ' ' ILE . 3.0 mm? -89.57 -6.59 56.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.571 -0.74 . . . . 0.0 109.53 170.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 63.8 t30 59.89 36.43 21.83 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 122.12 0.962 . . . . 0.0 108.901 -178.133 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.741 ' SD ' ' HB ' ' A' ' 70' ' ' THR . 2.6 tmm? -140.37 157.84 44.93 Favored 'General case' 0 N--CA 1.444 -0.732 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.392 -165.416 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . 0.481 ' N ' ' HG2' ' A' ' 66' ' ' MET . 0.0 OUTLIER -81.76 149.8 28.23 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.438 -177.788 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -24.2 67.48 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 111.657 0.243 . . . . 0.0 111.657 -176.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -60.63 -29.41 69.23 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.333 0.587 . . . . 0.0 110.111 176.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.741 ' HB ' ' SD ' ' A' ' 66' ' ' MET . 8.7 m -83.9 -53.09 5.84 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-N 115.173 -0.922 . . . . 0.0 110.314 176.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.855 HD21 HG22 ' A' ' 60' ' ' THR . 0.2 OUTLIER -54.61 -52.06 63.38 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 122.927 0.491 . . . . 0.0 110.879 -178.376 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -61.85 -46.38 89.69 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.592 -177.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 44.9 ttt180 -65.05 -32.16 73.73 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.915 0.388 . . . . 0.0 111.105 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.567 HG21 ' CD1' ' A' ' 46' ' ' ILE . 82.8 mt -67.28 -46.87 82.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.694 175.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 53.1 mt -65.19 -46.87 79.0 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-O 121.445 0.64 . . . . 0.0 110.245 176.502 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -69.11 -10.48 57.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 114.844 -1.071 . . . . 0.0 112.118 -174.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.466 ' HD3' ' O ' ' A' ' 77' ' ' LYS . 7.8 tmtm? -71.21 -26.11 62.8 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.79 -0.448 . . . . 0.0 109.79 178.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 3.5 mpt_? -79.34 46.97 0.77 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 121.747 0.784 . . . . 0.0 110.187 176.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.522 ' HB3' ' HD2' ' A' ' 80' ' ' PRO . 49.5 m -154.07 179.22 1.36 Allowed Pre-proline 0 C--N 1.318 -0.763 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.522 ' HD2' ' HB3' ' A' ' 79' ' ' SER . 32.8 Cg_exo -60.04 -25.99 81.23 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 121.888 1.725 . . . . 0.0 111.634 174.578 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.426 ' HE ' ' C ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.244 0.776 0 CA-C-O 117.787 -1.101 . . . . 0.0 110.297 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.789 ' HB2' ' HB2' ' A' ' 26' ' ' GLU . 86.1 mt . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.9 -155.53 0.12 Allowed 'General case' 0 C--O 1.235 0.31 0 O-C-N 123.241 0.338 . . . . 0.0 111.749 -178.3 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -53.56 -39.88 65.11 Favored 'General case' 0 N--CA 1.465 0.309 0 C-N-CA 123.168 0.587 . . . . 0.0 112.162 -175.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -59.88 -21.37 55.45 Favored Glycine 0 CA--C 1.519 0.341 0 CA-C-N 116.093 -0.503 . . . . 0.0 113.133 -178.847 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.789 ' HB2' ' HB2' ' A' ' 22' ' ' LEU . 10.6 tp10 -88.5 -68.15 0.79 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 177.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.4 t 179.05 164.95 0.9 Allowed 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 -177.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.64 133.57 86.67 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 110.116 -0.327 . . . . 0.0 110.116 177.585 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' PRO . . . . . 0.507 ' HA ' ' HD2' ' A' ' 30' ' ' PRO . 32.4 Cg_exo -30.1 112.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.353 0.805 0 C-N-CA 124.88 3.72 . . . . 0.0 114.431 179.311 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.507 ' HD2' ' HA ' ' A' ' 29' ' ' PRO . 8.7 Cg_endo -53.09 -37.18 79.03 Favored 'Trans proline' 0 CA--C 1.551 1.353 0 C-N-CA 123.615 2.877 . . . . 0.0 115.709 178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.484 ' HD3' ' HG2' ' A' ' 30' ' ' PRO . 65.6 Cg_exo -43.09 145.82 1.14 Allowed 'Trans proline' 0 C--N 1.37 1.7 0 C-N-CA 122.507 2.138 . . . . 0.0 113.765 177.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_endo -60.7 162.59 17.91 Favored 'Trans proline' 0 C--O 1.239 0.527 0 C-N-CA 123.33 2.687 . . . . 0.0 113.183 -177.168 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 66.98 -167.52 0.21 Allowed 'General case' 0 C--O 1.232 0.162 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.998 -174.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.429 ' HA ' ' HD2' ' A' ' 35' ' ' PRO . 57.2 t30 -118.62 126.44 27.16 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 176.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' A' ' 34' ' ' ASN . 3.8 Cg_exo -37.54 -39.28 0.68 Allowed 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 124.457 3.438 . . . . 0.0 113.736 179.538 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' MET . . . . . 0.414 ' O ' ' HG3' ' A' ' 36' ' ' MET . 19.6 ptp -104.11 85.62 2.42 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 121.703 0.763 . . . . 0.0 110.808 177.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . 0.491 ' O ' HG23 ' A' ' 41' ' ' VAL . 26.2 t -76.01 165.55 24.79 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 172.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -65.29 -37.37 86.95 Favored 'General case' 0 CA--C 1.513 -0.453 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 178.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -70.38 -37.94 74.64 Favored 'General case' 0 N--CA 1.446 -0.667 0 CA-C-N 114.97 -1.014 . . . . 0.0 110.111 175.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.429 ' HG2' ' O ' ' A' ' 35' ' ' PRO . 11.3 tpt180 -64.87 -45.13 87.31 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.784 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.491 HG23 ' O ' ' A' ' 37' ' ' SER . 76.1 t -57.52 -42.04 80.18 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.879 0.371 . . . . 0.0 110.435 178.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.734 ' O ' HG13 ' A' ' 46' ' ' ILE . 24.6 mtm180 -64.35 -49.21 72.58 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.442 177.466 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.564 ' CE3' ' HB ' ' A' ' 46' ' ' ILE . 0.0 OUTLIER -61.64 -37.06 82.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.029 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -59.68 -34.64 73.12 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.21 179.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' HIS . . . . . 0.656 ' O ' HG22 ' A' ' 49' ' ' ILE . 5.1 t60 -79.99 -31.99 39.78 Favored 'General case' 0 N--CA 1.448 -0.567 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 -178.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.754 ' CD1' HG21 ' A' ' 74' ' ' ILE . 24.1 mt -69.09 -35.06 66.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.766 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 51' ' ' GLU . 83.5 mm-40 -73.1 -48.8 32.64 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.021 0.439 . . . . 0.0 109.896 -177.628 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.671 ' O ' ' HG2' ' A' ' 52' ' ' MET . 0.0 OUTLIER -59.81 -30.69 69.09 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.447 -178.451 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ILE . . . . . 0.877 HD13 ' HD3' ' A' ' 63' ' ' ARG . 4.1 tp -86.07 -35.81 9.72 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.088 176.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.605 ' HB2' ' O ' ' A' ' 46' ' ' ILE . 2.2 t80 -59.86 -36.41 76.83 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.233 0.54 . . . . 0.0 109.716 178.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HG3' ' O ' ' A' ' 47' ' ' GLN . 45.4 mt-10 -73.51 -34.04 65.07 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.284 -0.871 . . . . 0.0 111.465 175.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' MET . . . . . 0.671 ' HG2' ' O ' ' A' ' 48' ' ' ARG . 74.0 mmm -59.36 -61.26 2.76 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-O 121.068 0.461 . . . . 0.0 112.23 -176.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.609 ' HB3' ' HB3' ' A' ' 56' ' ' ASN . 6.2 t -103.36 21.24 16.3 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.821 -170.139 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.8 t0 56.95 72.34 0.52 Allowed 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.71 -0.677 . . . . 0.0 111.858 175.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.578 ' HG2' ' CE2' ' A' ' 50' ' ' TYR . 78.6 mtt180 62.15 21.4 12.4 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.906 175.309 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.609 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 41.0 t-20 -76.07 95.52 3.64 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 175.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -61.75 -34.17 61.05 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.097 -177.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.0 m -59.04 -51.54 69.63 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.996 -179.018 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.59 ' OE1' ' HD2' ' A' ' 62' ' ' ARG . 6.0 tp10 -67.02 -38.68 86.38 Favored 'General case' 0 CA--C 1.514 -0.436 0 N-CA-C 109.802 -0.444 . . . . 0.0 109.802 178.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' THR . . . . . 0.857 HG22 HD21 ' A' ' 71' ' ' LEU . 30.4 m -57.39 -56.0 27.49 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.81 -178.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.566 ' HA ' HD23 ' A' ' 71' ' ' LEU . . . -55.81 -42.68 76.0 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.598 0.237 . . . . 0.0 110.913 178.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.59 ' HD2' ' OE1' ' A' ' 59' ' ' GLU . 0.3 OUTLIER -66.91 -44.63 80.27 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.105 0.479 . . . . 0.0 110.566 -177.466 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.877 ' HD3' HD13 ' A' ' 49' ' ' ILE . 12.8 ttt180 -75.38 -20.07 59.18 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.698 -177.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.748 ' HB3' ' SD ' ' A' ' 66' ' ' MET . 3.1 mm? -86.18 -11.52 52.29 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.711 174.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 14.4 m120 69.66 31.64 3.55 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.102 -179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' MET . . . . . 0.748 ' SD ' ' HB3' ' A' ' 64' ' ' LEU . 0.0 OUTLIER -127.24 168.4 14.78 Favored 'General case' 0 N--CA 1.45 -0.47 0 CA-C-O 121.863 0.839 . . . . 0.0 112.123 178.761 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 5.1 t-80 -80.69 161.68 24.51 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 114.127 -1.397 . . . . 0.0 109.566 -177.418 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.404 HH11 ' HD2' ' A' ' 68' ' ' ARG . 19.1 tpp85 -52.02 -51.79 55.03 Favored 'General case' 0 N--CA 1.468 0.438 0 CA-C-O 120.924 0.392 . . . . 0.0 111.761 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . 0.446 ' HA ' ' HD3' ' A' ' 69' ' ' ARG . 26.5 mmt180 -64.11 -28.52 69.83 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.925 -176.546 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' THR . . . . . 0.434 ' HB ' ' HB2' ' A' ' 66' ' ' MET . 3.9 m -62.36 -58.6 7.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.402 176.008 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.857 HD21 HG22 ' A' ' 60' ' ' THR . 0.2 OUTLIER -55.96 -46.23 78.65 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.509 -0.314 . . . . 0.0 110.318 -179.234 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 8.2 tp60 -56.74 -46.4 81.4 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.319 178.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 20.4 mtm180 -69.97 -29.42 66.52 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -176.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.754 HG21 ' CD1' ' A' ' 46' ' ' ILE . 1.4 mp -71.79 -43.66 69.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 C-N-CA 120.496 -0.482 . . . . 0.0 110.132 174.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 71' ' ' LEU . 78.0 mt -60.8 -46.3 91.06 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 121.483 0.659 . . . . 0.0 109.439 175.153 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -74.84 -11.73 60.21 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.624 -175.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.632 ' HE2' ' HB3' ' A' ' 81' ' ' ARG . 14.8 tmtt? -68.95 -18.5 64.09 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.086 178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 84.6 mtm180 -77.97 39.72 0.31 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.103 -175.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . 0.785 ' HB2' ' HD3' ' A' ' 80' ' ' PRO . 49.5 m -147.83 -54.35 0.02 OUTLIER Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.079 177.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PRO . . . . . 0.785 ' HD3' ' HB2' ' A' ' 79' ' ' SER . 9.0 Cg_exo -72.96 -19.16 23.6 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 122.868 2.379 . . . . 0.0 112.496 178.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.632 ' HB3' ' HE2' ' A' ' 77' ' ' LYS . 14.1 tpt180 . . . . . 0 C--O 1.245 0.86 0 CA-C-O 118.425 -0.798 . . . . 0.0 110.717 -179.249 . . . . . . . . 1 1 . 1 stop_ save_