data_2xc7_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 2xc7 _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 6' ' ' ASP . . . . . 0.765 ' HB3' HD13 ' A' ' 40' ' ' ILE . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.143 0 N-CA-C 112.571 0.582 . . . . 1.79 112.571 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 28.5 t -74.93 121.8 22.46 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.141 -1.059 . . . . 1.67 108.141 170.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.553 ' HB3' ' HB3' ' A' ' 36' ' ' ASN . 0.2 OUTLIER -56.64 -29.91 62.74 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.417 0.525 . . . . 2.09 112.417 -169.533 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.68 -47.96 70.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.907 0.384 . . . . 2.17 110.143 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -63.31 -40.49 97.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.887 -0.597 . . . . 3.07 110.25 175.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.1 t -57.44 -54.56 29.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 0.39 110.606 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -40.09 75.86 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.954 0.407 . . . . 1.1 111.576 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.71 -32.83 73.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.944 -0.571 . . . . 0.86 110.519 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -71.8 -48.15 48.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.739 -0.664 . . . . 2.05 111.013 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.602 HD11 HD22 ' A' ' 43' ' ' LEU . 1.2 mm -58.38 -50.89 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-O 121.277 0.561 . . . . 1.05 110.012 -178.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.527 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 12.7 p -59.08 -37.23 76.59 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.425 -0.807 . . . . 0.39 111.576 -175.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.71 -44.95 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.442 -0.344 . . . . 0.7 110.897 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.7 mtp85 -72.42 -29.47 63.74 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.507 0.558 . . . . 3.55 112.507 -173.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.616 ' HB3' ' HA3' ' A' ' 67' ' ' GLY . 3.8 mm? -93.97 0.04 55.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.758 0.313 . . . . 1.66 111.292 178.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 50.47 44.82 26.92 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 115.285 -0.871 . . . . 2.19 109.14 -173.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.841 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -61.26 120.15 52.37 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 114.523 -1.217 . . . . 1.67 112.427 -170.514 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 55.4 Cg_endo -64.46 -39.63 27.8 Favored 'Trans proline' 0 CA--C 1.529 0.273 0 C-N-CA 124.28 3.32 . . . . 0.41 113.084 174.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 pttt -120.45 63.8 0.84 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.195 0.522 . . . . 2.03 109.948 -172.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -56.25 -17.6 8.02 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.315 1.228 . . . . 2.27 114.315 -164.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.16 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 2.14 110.029 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.848 HD23 ' HA ' ' A' ' 89' ' ' PHE . 2.2 tm? -73.16 -51.57 17.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.573 -0.739 . . . . 2.02 110.387 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.841 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 7.3 tp -62.36 -32.29 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 116.231 -0.44 . . . . 1.18 111.03 -177.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.75 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -72.9 -33.0 65.74 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.56 0.695 . . . . 1.03 110.078 174.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.477 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 33.3 ttm180 -63.35 -40.92 98.61 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.23 -0.896 . . . . 1.96 111.908 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.657 ' HA ' HD12 ' A' ' 88' ' ' ILE . 33.0 t -53.19 -45.07 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 N-CA-C 108.781 -0.822 . . . . 1.15 108.781 177.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.75 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -53.02 -55.75 10.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.009 -1.45 . . . . 0.22 111.478 174.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -59.53 -40.14 86.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.608 -0.724 . . . . 4.21 111.304 -177.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.0 mm -75.3 -53.11 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.802 0.668 . . . . 1.5 112.802 -176.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.3 pt -88.06 -29.28 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 C-N-CA 120.061 -0.656 . . . . 1.12 112.248 -171.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.54 156.2 8.54 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.33 -0.938 . . . . 0.28 112.644 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.553 ' HB3' ' HB3' ' A' ' 8' ' ' GLN . 14.1 p-10 -62.25 -52.02 65.39 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.402 0.281 . . . . 0.99 111.568 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.495 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 84.8 tttt -71.74 -36.69 70.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 3.52 110.25 -179.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.1 mmmm -59.18 -29.76 67.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.701 -0.681 . . . . 3.03 111.269 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.89 68.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.828 0.347 . . . . 0.89 110.676 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.765 HD13 ' HB3' ' A' ' 6' ' ' ASP . 37.1 mt -72.21 -34.19 48.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 120.911 0.386 . . . . 1.78 110.578 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.628 ' HA ' ' HE3' ' A' ' 44' ' ' MET . 16.4 mm-40 -55.29 -39.62 70.08 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.219 -0.66 . . . . 2.1 109.219 172.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.791 HD21 ' HB3' ' A' ' 73' ' ' LEU . 66.8 mt -67.4 -35.51 79.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.346 -0.843 . . . . 1.09 111.101 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.602 HD22 HD11 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -60.4 -37.23 80.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.906 0.384 . . . . 2.0 111.07 178.307 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.628 ' HE3' ' HA ' ' A' ' 41' ' ' GLU . 39.5 mtm -72.53 -36.49 68.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.265 0.555 . . . . 2.68 109.632 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -71.07 -28.36 64.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.538 -0.755 . . . . 1.83 111.317 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.867 HG22 HD12 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -61.0 -35.95 78.19 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 110.235 -0.283 . . . . 1.5 110.235 178.064 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.5 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -65.52 -35.07 79.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.048 0.452 . . . . 1.4 110.714 175.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.56 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 30.2 tt0 -68.31 -39.9 81.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.174 0.511 . . . . 2.51 109.657 178.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.4 t -69.11 -33.54 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.76 110.035 173.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.716 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 2.6 mm-40 -59.96 -44.06 94.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 1.96 111.233 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 17.7 pt20 -72.82 -19.73 61.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 2.48 111.245 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -100.09 -25.28 14.35 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.04 0.448 . . . . 2.4 111.766 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.21 41.67 25.81 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.963 -0.562 . . . . 1.65 113.228 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.87 128.99 9.41 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.55 -0.833 . . . . 1.25 113.922 -175.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 1.072 HD22 ' HB2' ' A' ' 72' ' ' ASN . 2.2 tm? -177.43 125.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.947 0.403 . . . . 2.02 110.43 170.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.524 ' N ' HD21 ' A' ' 55' ' ' LEU . 94.1 m-85 -124.26 108.69 12.51 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.498 -0.927 . . . . 3.65 108.498 165.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.736 HD13 ' HB2' ' A' ' 62' ' ' ARG . 0.6 OUTLIER -82.84 -176.57 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.193 -0.458 . . . . 1.28 111.438 -178.277 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.81 -36.32 58.25 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.999 0.741 . . . . 1.44 112.999 -173.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.588 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 0.1 OUTLIER -88.71 -35.52 16.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.606 0.595 . . . . 2.28 112.606 -179.069 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.87 -19.86 10.89 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 121.64 -0.314 . . . . 1.21 112.492 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.588 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 57.8 m -71.13 -58.41 3.58 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.971 0.415 . . . . 2.35 110.145 177.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.736 ' HB2' HD13 ' A' ' 57' ' ' ILE . 99.8 mtt180 -67.96 138.1 55.67 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.655 -1.239 . . . . 3.36 107.655 167.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -142.63 126.01 16.65 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.421 -0.585 . . . . 4.14 109.421 -172.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.718 ' H ' HD13 ' A' ' 55' ' ' LEU . 0.0 OUTLIER 62.51 56.07 2.12 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.476 -0.784 . . . . 2.6 112.194 -175.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.908 HG21 ' HA2' ' A' ' 68' ' ' GLY . 2.2 t -78.82 139.21 57.74 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 108.114 -1.069 . . . . 1.26 108.114 167.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.521 ' O ' HD13 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.32 -59.76 1.1 Allowed 'Trans proline' 0 N--CA 1.48 0.685 0 C-N-CA 123.459 2.773 . . . . 0.51 112.978 -173.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.708 ' O ' HD22 ' A' ' 71' ' ' LEU . . . -66.35 -38.86 94.0 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.407 -0.902 . . . . 0.29 111.245 177.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.908 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.68 -34.97 65.41 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.333 -0.433 . . . . 0.32 112.909 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.445 ' CG2' ' HD2' ' A' ' 64' ' ' ARG . 98.8 t -59.04 -42.78 87.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.106 0.479 . . . . 0.74 110.133 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.56 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 10.5 t80 -65.59 -37.01 85.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.825 -0.625 . . . . 0.31 109.975 174.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.708 HD22 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.39 -34.58 70.88 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.761 -0.829 . . . . 1.14 108.761 177.744 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 1.072 ' HB2' HD22 ' A' ' 55' ' ' LEU . 65.4 t30 -60.04 -30.61 69.3 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.656 -0.702 . . . . 1.14 110.186 177.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.867 HD12 HG22 ' A' ' 46' ' ' THR . 84.9 mt -58.62 -34.26 70.95 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.619 -0.719 . . . . 1.07 112.111 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.579 ' HB3' HD13 ' A' ' 85' ' ' ILE . 7.3 mp -65.73 -20.34 66.24 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.109 0.48 . . . . 1.73 110.795 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.588 ' HE2' ' HA ' ' A' ' 72' ' ' ASN . 8.9 mtmm -92.79 -34.35 13.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.281 0.562 . . . . 2.47 110.254 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -87.46 -13.11 44.1 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.154 -0.93 . . . . 2.68 110.877 -173.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.51 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 14.7 t -62.76 130.26 93.64 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.737 0.78 . . . . 1.46 110.751 -177.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.51 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 2.8 Cg_exo -74.86 -39.95 1.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.439 2.76 . . . . 1.2 113.725 -171.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.2 m -112.94 16.15 19.5 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.105 1.15 . . . . 1.84 114.105 -167.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 55.8 mt -112.6 137.69 44.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 118.683 0.674 . . . . 1.93 111.437 -177.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.4 m -74.04 141.44 45.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.523 -0.762 . . . . 2.06 111.042 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.15 -27.56 69.04 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.182 -0.917 . . . . 2.89 112.869 -174.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.84 -46.72 84.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 2.06 110.137 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -60.68 -38.86 86.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 2.93 109.869 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.579 HD13 ' HB3' ' A' ' 74' ' ' LEU . 33.4 mm -60.03 -50.65 79.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.377 -0.829 . . . . 2.15 110.608 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 18.8 ttpt -60.06 -43.46 95.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.608 -0.724 . . . . 2.96 110.284 176.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -63.72 -34.31 77.58 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.411 -0.813 . . . . 1.7 111.715 -174.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.657 HD12 ' HA ' ' A' ' 30' ' ' VAL . 72.9 mt -70.29 -72.34 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.174 0.435 . . . . 1.21 112.174 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.848 ' HA ' HD23 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -106.48 -16.38 14.55 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.361 0.874 . . . . 1.16 113.361 -168.589 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.663 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 86.9 t80 -77.47 -24.75 50.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.355 0.598 . . . . 1.66 110.212 -173.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.561 -0.745 . . . . 1.23 109.721 174.051 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.721 ' HB2' HD21 ' A' ' 36' ' ' ASN . 3.6 m-20 . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 109.693 -0.484 . . . . 1.79 109.693 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.2 m -58.33 124.34 19.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.66 -0.496 . . . . 1.67 109.66 176.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.9 mt-30 -57.21 -32.28 66.33 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.883 -0.599 . . . . 2.09 112.155 -169.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.92 -42.1 73.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.065 0.46 . . . . 2.17 110.291 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -71.03 -38.87 72.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.815 -0.63 . . . . 3.07 110.277 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.3 t -58.12 -51.53 69.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.39 110.981 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.95 -37.52 63.99 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.088 0.47 . . . . 1.1 111.155 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -68.69 -41.23 79.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.643 -0.708 . . . . 0.86 110.191 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 41.1 mm-40 -64.77 -47.41 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.572 -0.74 . . . . 2.05 111.907 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.648 HD12 HD13 ' A' ' 43' ' ' LEU . 3.4 mm -60.38 -49.87 82.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.887 0.375 . . . . 1.05 110.326 -175.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.1 p -61.16 -32.66 72.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.95 -0.568 . . . . 0.39 111.314 -176.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -70.54 -44.98 66.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.162 -0.472 . . . . 0.7 110.649 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 77.8 mtt180 -75.25 -31.36 60.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 3.55 111.693 -173.199 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.622 HD11 ' HA3' ' A' ' 67' ' ' GLY . 3.9 mm? -82.54 -15.56 51.86 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.623 -0.431 . . . . 1.66 111.173 174.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 55.18 29.91 13.54 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 108.395 -0.965 . . . . 2.19 108.395 -170.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.473 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 24.7 tt0 -71.73 132.96 84.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 113.904 -1.498 . . . . 1.67 112.271 -168.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.434 ' HD2' ' HG3' ' A' ' 21' ' ' GLU . 38.8 Cg_endo -63.47 -49.01 4.94 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 124.737 3.625 . . . . 0.41 113.625 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.602 ' HZ1' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -89.99 69.81 7.41 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.006 0.908 . . . . 2.03 110.708 -175.314 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -66.88 -23.82 66.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.175 . . . . 2.27 112.513 -170.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.37 -37.28 86.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.364 0.602 . . . . 2.14 110.021 175.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.602 HD11 ' HZ1' ' A' ' 23' ' ' LYS . 1.4 tm? -72.93 -40.98 64.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.348 -0.842 . . . . 2.02 110.479 -178.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.473 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 3.8 tp -63.09 -31.15 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 121.079 0.466 . . . . 1.18 109.919 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.661 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.48 -34.09 65.17 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.913 -0.585 . . . . 1.03 110.562 174.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -62.3 -41.38 98.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.211 -0.45 . . . . 1.96 110.923 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 19.9 t -54.02 -44.59 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 N-CA-C 109.001 -0.74 . . . . 1.15 109.001 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.661 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 91.8 t -53.2 -49.04 53.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 114.34 -1.3 . . . . 0.22 111.038 175.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -60.55 -47.48 86.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.586 -0.734 . . . . 4.21 110.862 -178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 41.7 mm -73.94 -52.24 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.701 -0.681 . . . . 1.5 112.329 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 21.4 pt -84.94 -28.86 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.628 -0.429 . . . . 1.12 111.944 -172.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.21 155.98 9.94 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.4 -0.905 . . . . 0.28 112.263 -179.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.721 HD21 ' HB2' ' A' ' 6' ' ' ASP . 5.3 p-10 -59.51 -49.42 77.84 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.778 0.288 . . . . 0.99 111.778 -175.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -71.62 -33.67 69.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.811 0.339 . . . . 3.52 111.05 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.26 -31.68 72.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.038 -0.528 . . . . 3.03 110.832 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.477 ' O ' ' HG ' ' A' ' 43' ' ' LEU . . . -64.15 -44.73 91.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.28 -0.418 . . . . 0.89 110.454 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.05 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.124 -0.489 . . . . 1.78 110.317 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 51.4 mt-10 -58.41 -42.95 88.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.127 -0.488 . . . . 2.1 110.822 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.844 ' HB3' HD11 ' A' ' 73' ' ' LEU . 53.1 mt -63.27 -37.87 88.95 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.512 -0.313 . . . . 1.09 110.847 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.648 HD13 HD12 ' A' ' 15' ' ' ILE . 85.6 mt -60.99 -30.78 70.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.073 0.463 . . . . 2.0 111.123 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.2 tmm? -73.99 -39.17 63.85 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.352 -0.611 . . . . 2.68 109.352 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 31.0 mt-10 -70.45 -25.49 63.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.658 -0.701 . . . . 1.83 112.464 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.642 HG21 HD12 ' A' ' 73' ' ' LEU . 71.2 p -52.04 -41.5 62.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.921 0.391 . . . . 1.5 110.717 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.56 -35.07 75.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.684 -0.689 . . . . 1.4 111.418 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -68.85 -33.93 74.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.984 0.421 . . . . 2.51 110.498 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 81.5 t -76.96 -35.81 24.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.967 0.413 . . . . 0.76 110.323 174.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.555 ' HA ' HH21 ' A' ' 64' ' ' ARG . 6.7 mm-40 -61.05 -43.56 98.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.042 -0.526 . . . . 1.96 111.361 177.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -69.81 -26.27 64.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.813 0.339 . . . . 2.48 110.782 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -83.17 -25.07 32.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 2.4 111.04 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.49 ' HA3' ' NH1' ' A' ' 64' ' ' ARG . . . 72.95 44.4 37.09 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.521 -0.763 . . . . 1.65 111.804 -178.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.43 126.01 7.09 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.248 -0.977 . . . . 1.25 114.865 -170.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.72 HD12 ' HB2' ' A' ' 72' ' ' ASN . 38.6 tp -176.87 127.72 0.17 Allowed 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.23 0.538 . . . . 2.02 111.72 163.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -119.27 112.69 19.79 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 107.971 -1.122 . . . . 3.65 107.971 163.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.471 HD12 ' O ' ' A' ' 62' ' ' ARG . 1.1 pt -86.96 -165.36 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.805 -0.634 . . . . 1.28 111.516 -175.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.9 mtt -42.12 -46.33 4.28 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.876 0.735 . . . . 1.44 111.806 -173.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -120.82 -33.27 3.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.101 -0.499 . . . . 2.28 111.193 -174.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.46 ' O ' ' HB3' ' A' ' 63' ' ' ARG . . . 106.16 -12.07 44.41 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.285 -0.96 . . . . 1.21 115.257 172.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.4 ' C ' ' H ' ' A' ' 63' ' ' ARG . 65.8 p -65.28 -55.88 15.85 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 118.46 1.13 . . . . 2.35 111.17 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.471 ' O ' HD12 ' A' ' 57' ' ' ILE . 60.4 mtp180 -81.71 26.9 0.47 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.528 -0.76 . . . . 3.36 110.368 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.46 ' HB3' ' O ' ' A' ' 60' ' ' GLY . 25.8 ptt180 -46.53 133.39 10.15 Favored 'General case' 0 C--O 1.233 0.21 0 O-C-N 123.916 0.76 . . . . 4.14 112.434 -169.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.685 ' HA ' HD21 ' A' ' 55' ' ' LEU . 4.8 tpt180 73.14 80.67 0.13 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.002 -0.999 . . . . 2.6 111.817 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.883 HG22 ' HA2' ' A' ' 68' ' ' GLY . 0.3 OUTLIER -105.36 147.72 35.08 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.885 -1.052 . . . . 1.26 108.279 172.127 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.476 ' O ' HD11 ' A' ' 19' ' ' LEU . 9.9 Cg_endo -45.76 -59.69 1.1 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 123.536 2.824 . . . . 0.51 112.998 -176.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.666 ' O ' HD21 ' A' ' 71' ' ' LEU . . . -63.31 -40.74 99.31 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.085 -1.055 . . . . 0.29 110.85 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.883 ' HA2' HG22 ' A' ' 65' ' ' THR . . . -56.46 -29.56 57.43 Favored Glycine 0 CA--C 1.52 0.379 0 CA-C-N 115.139 -0.53 . . . . 0.32 113.289 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.47 ' CG2' ' HD2' ' A' ' 64' ' ' ARG . 41.5 t -67.75 -33.59 62.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.118 0.485 . . . . 0.74 109.997 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.604 ' HB2' HD13 ' A' ' 19' ' ' LEU . 12.1 t80 -65.23 -35.74 81.98 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.305 -0.628 . . . . 0.31 109.305 171.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.733 HD11 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -58.22 -36.26 72.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.462 -0.94 . . . . 1.14 108.462 178.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.72 ' HB2' HD12 ' A' ' 55' ' ' LEU . 44.0 t-20 -56.58 -35.21 67.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.651 -0.704 . . . . 1.14 109.9 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.844 HD11 ' HB3' ' A' ' 42' ' ' LEU . 95.6 mt -58.13 -37.01 73.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.153 -0.931 . . . . 1.07 112.178 -176.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.465 ' HB3' ' CG2' ' A' ' 85' ' ' ILE . 6.4 mp -65.83 -28.87 69.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.162 0.506 . . . . 1.73 110.479 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -80.92 -42.5 21.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.121 0.486 . . . . 2.47 110.648 176.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -100.28 26.12 6.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.728 -0.669 . . . . 2.68 111.363 -173.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.488 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 5.4 t -80.95 124.73 81.19 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 121.447 0.642 . . . . 1.46 110.517 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.4 Cg_exo -75.78 -9.97 19.83 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.29 2.66 . . . . 1.2 113.01 -176.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.5 m -111.51 -20.71 12.1 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.208 0.818 . . . . 1.84 113.208 -170.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.434 ' HB ' HG22 ' A' ' 77' ' ' THR . 17.7 mt -111.4 139.87 33.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.774 0.321 . . . . 1.93 111.313 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.8 t -76.17 142.0 41.69 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.31 0.576 . . . . 2.06 110.044 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.403 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 1.8 mp0 -57.23 -37.59 72.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.691 -1.141 . . . . 2.89 113.116 -168.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.54 -37.28 85.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 2.06 110.764 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -68.37 -23.64 64.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.587 0.708 . . . . 2.93 110.073 -177.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.465 ' CG2' ' HB3' ' A' ' 74' ' ' LEU . 46.5 mm -70.73 -36.96 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.839 -1.073 . . . . 2.15 111.169 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.541 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 37.4 ttmt -56.83 -36.15 69.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.485 -0.78 . . . . 2.96 111.896 -177.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.52 -33.29 69.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 1.7 111.629 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.7 mt -70.95 -72.21 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 113.167 0.803 . . . . 1.21 113.167 -170.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.733 ' HD1' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -104.3 -19.19 14.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.695 0.628 . . . . 1.16 112.695 -166.854 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.541 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 60.5 t80 -74.83 -23.86 58.52 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.311 0.577 . . . . 1.66 110.945 -173.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 47.1 mt . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 115.605 -0.725 . . . . 1.23 111.022 -176.563 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.525 ' HB2' ' CG2' ' A' ' 11' ' ' VAL . 12.0 p-10 . . . . . 0 N--CA 1.451 -0.382 0 CA-C-O 121.713 0.768 . . . . 1.79 111.67 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.5 m -79.86 127.87 32.75 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.443 -0.799 . . . . 1.67 109.363 175.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.714 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 3.4 pt20 -51.91 -43.65 63.49 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.731 1.011 . . . . 2.09 113.731 -167.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -71.36 -34.95 70.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.115 0.483 . . . . 2.17 110.268 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -65.67 -42.19 91.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 3.07 109.666 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.525 ' CG2' ' HB2' ' A' ' 6' ' ' ASP . 60.2 t -62.15 -42.85 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.602 -0.726 . . . . 0.39 110.431 176.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.73 -41.7 77.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 1.1 111.36 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.27 -31.11 71.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.318 -0.401 . . . . 0.86 110.418 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.64 -50.54 64.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.463 -0.335 . . . . 2.05 110.779 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.467 HD12 HD13 ' A' ' 43' ' ' LEU . 2.0 mm -60.57 -49.48 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.768 0.318 . . . . 1.05 110.555 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.503 ' HB2' ' HD2' ' A' ' 24' ' ' LYS . 18.9 p -57.96 -43.04 86.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.864 -0.607 . . . . 0.39 111.454 -176.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.72 -41.52 98.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.666 -0.697 . . . . 0.7 111.141 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -77.42 -36.91 52.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 3.55 111.905 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.864 HD13 ' HA3' ' A' ' 67' ' ' GLY . 4.5 mm? -83.04 -5.61 59.17 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.973 0.36 . . . . 1.66 111.973 -178.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 55.82 39.97 30.68 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.762 -0.829 . . . . 2.19 108.762 -172.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.797 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.12 120.34 63.5 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.31 -1.313 . . . . 1.67 111.753 -171.065 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.08 -34.96 12.55 Favored 'Trans proline' 0 N--CA 1.474 0.351 0 C-N-CA 123.976 3.117 . . . . 0.41 113.478 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.434 ' HE3' ' HG ' ' A' ' 26' ' ' LEU . 35.5 pttt -120.38 66.24 0.83 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.319 0.58 . . . . 2.03 109.499 -173.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HD2' ' HB2' ' A' ' 16' ' ' SER . 40.1 mtmt -61.06 -12.41 11.78 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.035 1.124 . . . . 2.27 114.035 -163.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -69.23 -28.66 66.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.339 -0.544 . . . . 2.14 109.581 173.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.849 HD23 ' HA ' ' A' ' 89' ' ' PHE . 1.8 tm? -71.84 -52.05 19.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.46 -0.791 . . . . 2.02 109.926 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.797 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 10.1 tp -62.22 -34.58 64.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 1.18 110.525 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.718 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -70.88 -32.24 69.16 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.548 0.69 . . . . 1.03 110.477 174.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -66.91 -41.6 86.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.548 -0.751 . . . . 1.96 111.587 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . 0.491 ' HA ' HD11 ' A' ' 88' ' ' ILE . 16.3 t -53.4 -44.72 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 108.66 -0.867 . . . . 1.15 108.66 176.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.718 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.1 t -52.51 -53.42 20.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 113.63 -1.623 . . . . 0.22 111.201 175.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -66.24 -35.51 80.6 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.56 -0.745 . . . . 4.21 112.06 -174.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 50.5 mm -75.03 -51.82 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.294 0.479 . . . . 1.5 112.294 -177.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.7 pt -90.18 -25.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.89 0.376 . . . . 1.12 111.854 -175.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.1 139.56 6.24 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.722 -0.751 . . . . 0.28 111.356 -175.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.714 ' HB3' ' HA ' ' A' ' 8' ' ' GLN . 0.9 OUTLIER -55.55 -37.95 68.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.834 0.349 . . . . 0.99 111.86 -179.195 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -71.58 -33.87 69.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.145 0.498 . . . . 3.52 110.262 -178.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -69.86 -31.12 68.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.934 -0.576 . . . . 3.03 110.714 176.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.79 -38.66 91.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.13 0.49 . . . . 0.89 110.222 175.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.26 -41.65 93.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 115.912 -0.585 . . . . 1.78 110.441 176.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -55.73 -47.0 77.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.779 -0.646 . . . . 2.1 110.448 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.754 ' HB3' HD11 ' A' ' 73' ' ' LEU . 48.5 mt -60.58 -38.62 85.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.619 -0.719 . . . . 1.09 111.26 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.467 HD13 HD12 ' A' ' 15' ' ' ILE . 14.4 mt -60.05 -32.48 70.96 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.877 0.37 . . . . 2.0 111.498 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.8 mtp -74.59 -37.01 63.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.111 0.481 . . . . 2.68 109.881 175.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -70.55 -27.45 64.15 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.444 -0.798 . . . . 1.83 111.623 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.526 HG22 HD12 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -62.87 -39.12 93.46 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.767 0.317 . . . . 1.5 110.833 -177.878 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.59 -44.15 89.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.53 . . . . 1.4 111.785 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.925 ' HA ' ' HG2' ' A' ' 51' ' ' GLN . 6.6 pt-20 -75.69 -30.27 59.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.671 -0.412 . . . . 2.51 111.422 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 84.5 t -65.23 -35.62 75.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.496 0.665 . . . . 0.76 109.421 173.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.29 -47.02 65.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.553 -0.748 . . . . 1.96 111.121 175.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.925 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 17.0 pt20 -65.12 -27.04 68.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 2.48 110.728 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -94.27 -4.19 49.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.047 -0.524 . . . . 2.4 111.454 -177.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.23 50.08 41.76 Favored Glycine 0 C--N 1.331 0.28 0 CA-C-N 115.919 -0.582 . . . . 1.65 113.386 176.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -108.93 111.96 3.37 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.231 -0.985 . . . . 1.25 113.975 -177.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.66 HD12 ' HB2' ' A' ' 72' ' ' ASN . 34.6 tp -177.34 126.95 0.15 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.576 0.584 . . . . 2.02 112.576 167.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -125.65 93.54 3.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.592 -0.731 . . . . 3.65 109.081 164.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.688 HD13 ' HB3' ' A' ' 62' ' ' ARG . 3.8 pt -72.15 -170.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 112.451 0.537 . . . . 1.28 112.451 -176.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.419 ' H ' ' HB ' ' A' ' 57' ' ' ILE . 2.7 mtt -42.01 -47.63 4.46 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.88 0.738 . . . . 1.44 111.468 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.481 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 6.1 p30 -103.89 -35.81 8.02 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.797 -0.638 . . . . 2.28 111.746 -172.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 97.13 -19.52 54.47 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.069 -0.586 . . . . 1.21 113.701 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.481 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 66.1 m -72.61 -45.5 58.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.183 0.492 . . . . 2.35 111.251 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.688 ' HB3' HD13 ' A' ' 57' ' ' ILE . 7.4 ttm180 -80.47 49.37 1.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.91 0.862 . . . . 3.36 109.091 176.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.4 123.17 12.15 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.651 -1.159 . . . . 4.14 111.543 -173.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.426 ' HG2' ' HB3' ' A' ' 55' ' ' LEU . 1.2 mmm180 72.27 56.81 0.15 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 113.452 0.908 . . . . 2.6 113.452 173.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.73 HG21 ' HA2' ' A' ' 68' ' ' GLY . 3.9 t -77.74 140.65 63.51 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.657 -0.701 . . . . 1.26 109.159 169.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -48.18 -59.45 1.24 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 C-N-CA 124.047 3.165 . . . . 0.51 113.43 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.864 ' HA3' HD13 ' A' ' 19' ' ' LEU . . . -62.26 -39.86 98.26 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.868 -0.893 . . . . 0.29 110.868 177.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.73 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -58.94 -31.67 68.85 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.109 -0.546 . . . . 0.32 113.247 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 43.2 t -62.76 -36.39 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.181 0.515 . . . . 0.74 110.239 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.563 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 13.4 t80 -65.48 -36.37 83.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.955 -0.566 . . . . 0.31 109.634 173.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.612 HD22 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -59.4 -34.64 72.7 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.605 -0.887 . . . . 1.14 108.605 178.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.66 ' HB2' HD12 ' A' ' 55' ' ' LEU . 62.1 t30 -61.27 -30.41 70.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.266 -0.879 . . . . 1.14 110.489 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.754 HD11 ' HB3' ' A' ' 42' ' ' LEU . 71.1 mt -57.99 -36.09 72.14 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.296 -0.865 . . . . 1.07 111.885 -177.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.522 ' HB3' HD13 ' A' ' 85' ' ' ILE . 8.2 mp -60.83 -21.9 63.64 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.105 0.478 . . . . 1.73 110.859 -178.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -93.05 -38.45 11.62 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.989 -0.445 . . . . 2.47 111.576 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.609 ' OD1' ' HA ' ' A' ' 73' ' ' LEU . 2.9 p-10 -93.37 -8.14 42.73 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.914 -0.315 . . . . 2.68 111.648 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.553 HG22 ' HB ' ' A' ' 80' ' ' ILE . 7.9 t -56.22 127.65 70.98 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.436 0.636 . . . . 1.46 111.333 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.3 Cg_exo -76.07 -14.82 18.76 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.551 2.834 . . . . 1.2 113.055 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.6 m -112.31 -17.27 12.78 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.451 0.908 . . . . 1.84 113.451 -169.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.553 ' HB ' HG22 ' A' ' 77' ' ' THR . 36.5 mt -103.84 139.98 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.03 0.443 . . . . 1.93 112.096 -169.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 46.9 m -84.33 156.57 21.84 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.805 -0.634 . . . . 2.06 111.678 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.458 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 34.3 tt0 -65.92 -41.31 91.55 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.248 1.203 . . . . 2.89 114.248 -164.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.86 -47.03 85.13 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.55 -0.46 . . . . 2.06 111.63 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -56.83 -33.56 66.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 2.93 110.528 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.522 HD13 ' HB3' ' A' ' 74' ' ' LEU . 36.3 mm -60.12 -50.74 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.796 -0.638 . . . . 2.15 110.652 177.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.514 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.8 ttpt -59.25 -39.1 81.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 2.96 110.753 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -65.84 -33.07 74.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.437 -0.347 . . . . 1.7 111.652 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.491 HD11 ' HA ' ' A' ' 30' ' ' VAL . 75.2 mt -70.44 -71.44 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.457 0.54 . . . . 1.21 112.457 -174.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.849 ' HA ' HD23 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -104.8 -10.78 17.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.32 0.859 . . . . 1.16 113.32 -165.836 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.514 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.9 t80 -89.46 -22.51 22.46 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.167 0.508 . . . . 1.66 110.947 -173.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.5 mt . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.092 -0.504 . . . . 1.23 110.852 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 . . . . . 0 N--CA 1.453 -0.321 0 CA-C-O 121.188 0.518 . . . . 1.79 109.944 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -56.03 131.84 48.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.463 -0.79 . . . . 1.67 109.427 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.54 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 96.7 mt-30 -58.44 -33.31 69.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.031 -0.531 . . . . 2.09 112.249 -173.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.15 -40.23 86.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.133 0.492 . . . . 2.17 110.42 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.561 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 62.5 tttm -70.24 -42.37 72.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.759 -0.655 . . . . 3.07 110.262 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 91.1 t -59.26 -42.61 87.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.39 110.598 177.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.68 -41.42 73.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.038 0.447 . . . . 1.1 110.57 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -67.35 -42.12 84.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 0.86 110.426 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 71.6 mm-40 -56.86 -51.03 70.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.108 -0.496 . . . . 2.05 110.74 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.467 ' O ' HD21 ' A' ' 19' ' ' LEU . 4.6 mm -63.47 -51.8 66.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 120.709 -0.396 . . . . 1.05 110.318 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.651 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 31.4 p -64.03 -41.59 97.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.445 -0.343 . . . . 0.39 111.759 -172.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -62.54 -44.62 95.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.066 0.46 . . . . 0.7 110.646 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.2 mtt180 -78.73 -31.16 46.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.202 -0.454 . . . . 3.55 111.833 -175.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 1.093 HD11 ' HA3' ' A' ' 67' ' ' GLY . 4.3 mm? -77.56 -15.73 59.08 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 111.926 0.343 . . . . 1.66 111.926 177.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 57.15 41.22 27.48 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 107.65 -1.241 . . . . 2.19 107.65 -166.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.671 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 7.2 tp10 -81.18 115.7 57.95 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 113.243 -1.799 . . . . 1.67 110.968 -170.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 42.2 Cg_endo -61.98 -47.88 9.66 Favored 'Trans proline' 0 N--CA 1.477 0.535 0 C-N-CA 124.416 3.411 . . . . 0.41 113.521 177.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.726 ' HZ3' HD12 ' A' ' 71' ' ' LEU . 45.1 pttt -92.59 72.52 5.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.058 0.932 . . . . 2.03 109.649 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HA ' ' CG2' ' A' ' 27' ' ' ILE . 65.5 mttt -65.23 -17.66 64.67 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.428 -1.26 . . . . 2.27 111.441 -173.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.34 -39.06 59.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.418 -0.355 . . . . 2.14 110.524 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.443 ' O ' HD11 ' A' ' 26' ' ' LEU . 1.8 tm? -73.43 -43.61 60.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.003 0.43 . . . . 2.02 109.966 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.671 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 10.6 tp -64.08 -26.92 41.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.969 -0.56 . . . . 1.18 109.756 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.693 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.22 -33.31 65.27 Favored 'General case' 0 CA--C 1.523 -0.073 0 CA-C-N 116.267 -0.424 . . . . 1.03 110.934 172.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.448 ' HD3' ' HA ' ' A' ' 88' ' ' ILE . 6.3 ttm180 -59.35 -45.74 90.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.718 0.266 . . . . 1.96 111.718 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.5 p -57.55 -36.71 54.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.594 -0.521 . . . . 1.15 109.594 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.693 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 76.8 t -54.87 -50.51 61.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.112 -0.949 . . . . 0.22 110.779 173.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -63.49 -43.19 97.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.398 -0.819 . . . . 4.21 111.41 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 17.2 mt -74.96 -51.89 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.02 0.748 . . . . 1.5 113.02 -172.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 38' ' ' LYS . 34.1 pt -88.34 -28.2 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 120.274 -0.57 . . . . 1.12 111.661 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 153.86 8.66 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.363 -0.922 . . . . 0.28 112.492 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.54 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 24.7 p-10 -61.44 -40.25 93.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.672 0.272 . . . . 0.99 111.112 -179.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 87.2 tttt -72.06 -41.68 67.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.364 -0.38 . . . . 3.52 110.657 -178.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.521 ' HB3' HD11 ' A' ' 34' ' ' ILE . 13.8 mmmt -64.67 -27.72 69.12 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.114 -0.234 . . . . 3.03 111.365 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.34 -40.2 85.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.053 0.454 . . . . 0.89 109.904 174.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 45.3 mm -70.08 -40.13 78.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.89 -0.595 . . . . 1.78 110.079 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 15.5 mm-40 -58.65 -43.25 89.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.841 -0.618 . . . . 2.1 110.395 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.722 HD21 ' HB3' ' A' ' 73' ' ' LEU . 34.8 mt -59.98 -33.76 72.39 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.254 -0.43 . . . . 1.09 110.846 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.434 HD12 HD11 ' A' ' 15' ' ' ILE . 63.1 mt -62.91 -32.42 73.7 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.879 -0.328 . . . . 2.0 110.553 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.7 mmm -76.97 -39.64 49.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.935 0.398 . . . . 2.68 110.072 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.8 mt-10 -60.5 -27.18 67.39 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.699 -0.682 . . . . 1.83 111.501 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.55 HG21 ' O ' ' A' ' 42' ' ' LEU . 72.4 p -56.86 -37.48 71.38 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-O 120.607 0.241 . . . . 1.5 110.806 177.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.67 -37.58 82.06 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.057 -0.52 . . . . 1.4 111.754 -173.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.57 -37.2 82.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.939 0.399 . . . . 2.51 110.03 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -76.28 -32.65 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.023 0.44 . . . . 0.76 110.194 176.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.97 ' HA ' HH22 ' A' ' 64' ' ' ARG . 33.3 mm-40 -59.64 -48.56 81.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 1.96 111.541 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -69.89 -21.52 63.31 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.984 0.365 . . . . 2.48 111.984 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -96.99 -25.84 15.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.964 0.411 . . . . 2.4 112.001 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.27 45.62 14.52 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 116.011 -0.54 . . . . 1.65 113.506 176.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -102.29 129.01 9.74 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.488 -0.863 . . . . 1.25 114.5 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.919 HD11 ' HB2' ' A' ' 72' ' ' ASN . 58.9 tp -176.58 127.77 0.19 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.229 0.538 . . . . 2.02 112.16 165.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -121.33 108.88 14.23 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.563 -1.273 . . . . 3.65 107.563 162.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.441 ' CG2' HD23 ' A' ' 55' ' ' LEU . 0.9 OUTLIER -80.89 -174.93 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.426 -0.352 . . . . 1.28 111.904 -174.102 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -33.46 64.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.68 0.622 . . . . 1.44 112.68 -173.156 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -89.65 -36.46 15.24 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.179 -0.608 . . . . 2.28 112.166 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.85 -15.34 32.36 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.734 -0.547 . . . . 1.21 111.734 -175.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.0 m -72.58 -59.85 2.52 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.32 0.581 . . . . 2.35 110.961 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -85.09 145.69 27.52 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 106.255 -1.757 . . . . 3.36 106.255 167.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -132.27 130.97 41.59 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 119.358 -0.937 . . . . 4.14 110.645 -177.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.97 HH22 ' HA ' ' A' ' 50' ' ' GLU . 9.2 tpt180 69.95 88.13 0.11 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.932 0.872 . . . . 2.6 112.359 172.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.783 HG21 ' HA2' ' A' ' 68' ' ' GLY . 1.3 t -110.37 147.49 36.46 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.83 -1.077 . . . . 1.26 109.072 172.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -45.25 -58.85 1.38 Allowed 'Trans proline' 0 N--CA 1.486 1.077 0 C-N-CA 123.939 3.093 . . . . 0.51 113.29 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 1.093 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -63.46 -42.29 99.04 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 110.545 -1.022 . . . . 0.29 110.545 176.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.783 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.56 -28.93 56.91 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.667 -0.767 . . . . 0.32 113.403 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.512 ' CG2' ' HD2' ' A' ' 64' ' ' ARG . 22.7 t -67.53 -36.67 77.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.199 0.523 . . . . 0.74 110.008 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.575 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 7.6 t80 -66.08 -37.31 85.46 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.792 -0.64 . . . . 0.31 109.438 171.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.726 HD12 ' HZ3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -58.22 -36.8 73.68 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 108.21 -1.033 . . . . 1.14 108.21 176.249 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.919 ' HB2' HD11 ' A' ' 55' ' ' LEU . 65.3 t30 -60.31 -30.91 69.8 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.133 -0.94 . . . . 1.14 110.302 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.722 ' HB3' HD21 ' A' ' 42' ' ' LEU . 50.5 mt -60.77 -39.53 89.15 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.831 -0.622 . . . . 1.07 112.008 -178.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.515 HD23 ' CD1' ' A' ' 89' ' ' PHE . 8.3 mp -57.68 -34.94 69.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.055 0.455 . . . . 1.73 110.807 -178.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.779 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 0.3 OUTLIER -93.72 -6.02 47.13 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.209 -0.307 . . . . 2.47 110.828 -177.145 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -115.21 -27.87 7.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.516 -0.311 . . . . 2.68 111.759 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.509 HG22 ' HB ' ' A' ' 80' ' ' ILE . 13.8 t -58.0 117.68 21.29 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-O 122.011 0.91 . . . . 1.46 110.201 -177.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.509 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.1 Cg_exo -72.94 -15.71 26.16 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 123.511 2.808 . . . . 1.2 113.857 -161.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 40.0 t -105.96 5.5 30.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.672 0.273 . . . . 1.84 111.649 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.509 ' HB ' HG22 ' A' ' 77' ' ' THR . 34.0 mm -115.78 139.26 43.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.616 0.246 . . . . 1.93 110.792 -176.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.2 t -78.68 140.96 38.3 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.204 0.526 . . . . 2.06 110.863 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.29 -34.47 78.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 114.92 -1.036 . . . . 2.89 111.949 -175.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.78 -43.66 98.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.116 0.484 . . . . 2.06 110.551 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.15 -28.53 70.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.56 -0.746 . . . . 2.93 110.398 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.511 HD13 ' HB3' ' A' ' 74' ' ' LEU . 47.1 mm -69.88 -34.42 60.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.19 -0.914 . . . . 2.15 111.461 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.7 tmmm? -58.78 -34.85 71.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.093 0.473 . . . . 2.96 110.215 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.88 -31.31 67.93 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.922 -0.581 . . . . 1.7 111.087 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.448 ' HA ' ' HD3' ' A' ' 29' ' ' ARG . 34.8 mt -68.72 -67.82 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.625 0.602 . . . . 1.21 112.625 -173.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.542 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -112.29 -9.28 13.89 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.515 0.931 . . . . 1.16 113.515 -169.315 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.542 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 82.7 t80 -87.91 -24.87 23.5 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.076 0.465 . . . . 1.66 110.751 -174.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 24.2 mt . . . . . 0 C--N 1.324 -0.531 0 CA-C-O 121.797 0.808 . . . . 1.23 109.864 177.736 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 p30 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 121.168 0.508 . . . . 1.79 111.14 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.411 ' HB2' ' HB3' ' A' ' 10' ' ' LYS . 0.3 OUTLIER -63.24 119.28 9.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.663 -0.495 . . . . 1.67 109.663 175.628 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -49.54 -47.97 48.67 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.098 0.407 . . . . 2.09 112.098 -167.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.83 -51.09 63.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.822 0.344 . . . . 2.17 110.915 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.411 ' HB3' ' HB2' ' A' ' 7' ' ' SER . 34.3 tttm -55.28 -48.11 74.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.725 -0.67 . . . . 3.07 110.793 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.557 ' HA ' ' HG2' ' A' ' 14' ' ' GLU . 72.2 t -60.33 -53.41 49.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.845 -0.616 . . . . 0.39 110.302 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . 0.43 ' HB3' ' CB ' ' A' ' 28' ' ' ALA . . . -53.86 -39.29 65.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.261 0.553 . . . . 1.1 111.256 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.43 -45.46 76.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.494 -0.775 . . . . 0.86 110.625 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 0.557 ' HG2' ' HA ' ' A' ' 11' ' ' VAL . 15.4 pt-20 -76.39 -26.54 55.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.151 -0.477 . . . . 2.05 112.06 -176.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.646 HD11 HD22 ' A' ' 43' ' ' LEU . 28.3 mm -56.34 -53.75 36.26 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 N-CA-C 108.946 -0.761 . . . . 1.05 108.946 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.65 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 22.0 p -66.52 -33.87 76.64 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.148 -0.933 . . . . 0.39 111.076 -178.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -58.61 -41.7 86.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.054 -0.521 . . . . 0.7 110.451 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 52.7 mtt180 -77.74 -31.97 52.44 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.351 -0.386 . . . . 3.55 110.859 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.474 ' N ' HD21 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -82.67 -20.48 36.11 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.068 -0.515 . . . . 1.66 111.629 -174.688 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 58.64 33.93 23.45 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.12 -1.067 . . . . 2.19 108.12 -164.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.65 ' HB2' ' HA ' ' A' ' 16' ' ' SER . 0.3 OUTLIER -61.58 130.68 92.27 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 113.375 -1.739 . . . . 1.67 112.396 -173.203 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -72.57 -33.04 8.99 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 124.125 3.217 . . . . 0.41 113.47 172.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.552 ' HZ2' HD12 ' A' ' 71' ' ' LEU . 42.6 pttt -113.35 67.81 0.67 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.084 0.945 . . . . 2.03 109.679 -174.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -66.16 -17.8 64.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.32 -1.309 . . . . 2.27 111.49 -172.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -76.19 -39.39 54.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.316 -0.402 . . . . 2.14 110.359 175.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.461 HD21 ' O ' ' A' ' 26' ' ' LEU . 5.2 tt -73.58 -36.49 65.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.797 -0.446 . . . . 2.02 109.797 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 27' ' ' ILE . 1.9 tp -65.77 -27.51 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.626 -0.509 . . . . 1.18 109.626 176.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.705 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.3 -34.57 63.54 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.318 0.58 . . . . 1.03 110.363 171.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.425 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 16.7 ttm180 -61.37 -47.82 84.1 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.498 -0.774 . . . . 1.96 111.5 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -58.49 -37.26 63.35 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.082 0 N-CA-C 109.73 -0.47 . . . . 1.15 109.73 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.705 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 41.1 t -52.57 -53.57 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.426 -0.807 . . . . 0.22 110.371 173.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.87 -42.41 99.75 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.347 -0.842 . . . . 4.21 111.052 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 32.7 mt -75.38 -52.15 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 113.312 0.856 . . . . 1.5 113.312 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.647 HD13 ' HG3' ' A' ' 38' ' ' LYS . 31.4 pt -82.3 -21.99 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.195 -0.602 . . . . 1.12 111.083 -176.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.33 146.45 9.24 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.584 -0.817 . . . . 0.28 111.438 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -63.42 -40.3 96.82 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 122.394 0.278 . . . . 0.99 111.519 -177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.744 ' HD2' ' H ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -72.26 -34.01 67.92 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.802 -0.359 . . . . 3.52 110.991 178.694 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.647 ' HG3' HD13 ' A' ' 34' ' ' ILE . 14.6 tppt? -61.7 -42.0 98.35 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 110.145 -0.317 . . . . 3.03 110.145 176.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.457 ' O ' HD23 ' A' ' 43' ' ' LEU . . . -60.44 -42.39 96.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.051 -0.522 . . . . 0.89 110.49 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.9 mm -61.37 -42.6 94.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.89 -0.595 . . . . 1.78 110.625 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 37' ' ' LYS . 46.9 mt-10 -61.22 -38.23 85.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.236 -0.438 . . . . 2.1 110.429 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.954 HD23 ' HB3' ' A' ' 73' ' ' LEU . 75.3 mt -65.41 -31.04 71.93 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.105 -0.498 . . . . 1.09 111.378 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.646 HD22 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -62.35 -28.93 70.1 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.922 -0.486 . . . . 2.0 110.793 175.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.8 mtp -75.4 -35.21 61.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.322 0.582 . . . . 2.68 109.794 171.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.564 ' HB2' HD11 ' A' ' 73' ' ' LEU . 11.0 mm-40 -70.04 -26.8 64.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.536 -0.756 . . . . 1.83 111.461 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 43.3 p -57.01 -47.58 80.53 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.365 -0.606 . . . . 1.5 109.365 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.503 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -64.57 -35.81 82.18 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.837 -0.619 . . . . 1.4 110.914 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.651 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 21.9 tp10 -59.2 -49.3 78.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.925 -0.579 . . . . 2.51 109.566 176.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 79.7 t -70.58 -33.38 53.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.184 -0.462 . . . . 0.76 110.821 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.702 ' HA ' HH22 ' A' ' 64' ' ' ARG . 6.4 mm-40 -59.94 -34.48 73.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.6 -0.273 . . . . 1.96 111.612 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.651 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.1 pt20 -83.1 -24.03 32.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 2.48 110.644 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -88.8 -27.59 21.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 2.4 111.176 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.58 50.27 38.26 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 115.745 -0.661 . . . . 1.65 113.352 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -132.28 121.24 2.94 Favored Glycine 0 C--O 1.223 -0.55 0 C-N-CA 119.706 -1.235 . . . . 1.25 114.225 -177.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.819 HD22 ' HB2' ' A' ' 72' ' ' ASN . 1.9 tm? -165.23 125.51 1.88 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.885 0.374 . . . . 2.02 110.165 171.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.513 ' N ' HD21 ' A' ' 55' ' ' LEU . 90.1 m-85 -119.16 113.73 21.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.77 -0.826 . . . . 3.65 108.77 171.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.66 HD13 ' HB2' ' A' ' 62' ' ' ARG . 0.2 OUTLIER -87.37 -161.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.72 -0.673 . . . . 1.28 111.976 -175.493 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 3.2 mtt -44.49 -48.71 10.1 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 123.759 0.662 . . . . 1.44 110.949 -175.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.432 HD21 ' H ' ' A' ' 61' ' ' SER . 1.1 p-10 -107.98 -28.32 9.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.738 -0.665 . . . . 2.28 111.338 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.88 -18.84 37.14 Favored Glycine 0 C--O 1.224 -0.505 0 C-N-CA 120.853 -0.689 . . . . 1.21 112.888 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.432 ' H ' HD21 ' A' ' 59' ' ' ASN . 40.5 m -56.76 -45.95 81.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.161 0.43 . . . . 2.35 112.161 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.66 ' HB2' HD13 ' A' ' 57' ' ' ILE . 35.2 mtp180 -84.43 43.17 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.932 0.873 . . . . 3.36 109.326 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 63' ' ' ARG . 38.4 ttp180 -47.01 130.06 12.17 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 113.552 -1.658 . . . . 4.14 112.611 -170.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.702 HH22 ' HA ' ' A' ' 50' ' ' GLU . 0.1 OUTLIER 64.13 71.82 0.47 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.248 -0.887 . . . . 2.6 112.822 -178.274 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.852 HG21 ' HA2' ' A' ' 68' ' ' GLY . 3.1 t -90.49 140.76 26.88 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 107.973 -1.121 . . . . 1.26 107.973 166.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -47.7 -58.16 1.9 Allowed 'Trans proline' 0 N--CA 1.48 0.72 0 C-N-CA 123.581 2.854 . . . . 0.51 113.262 -171.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.635 ' O ' HD21 ' A' ' 71' ' ' LEU . . . -69.29 -40.33 81.07 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.284 -0.96 . . . . 0.29 111.245 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.852 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -55.97 -28.2 52.75 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.515 -0.342 . . . . 0.32 113.075 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.548 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 70.4 t -63.09 -39.02 83.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.144 0.497 . . . . 0.74 110.69 176.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.452 ' CG ' HD12 ' A' ' 19' ' ' LEU . 6.9 t80 -66.32 -34.84 78.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.219 -0.446 . . . . 0.31 110.022 172.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.654 HD11 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -55.3 -33.52 63.35 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 108.658 -0.867 . . . . 1.14 108.658 176.705 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.819 ' HB2' HD22 ' A' ' 55' ' ' LEU . 27.8 t-20 -56.06 -40.53 73.68 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.954 -0.566 . . . . 1.14 109.976 174.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.954 ' HB3' HD23 ' A' ' 42' ' ' LEU . 34.5 mt -67.91 -38.15 82.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.599 -0.728 . . . . 1.07 111.031 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.657 ' O ' HD11 ' A' ' 85' ' ' ILE . 5.0 tt -57.56 -38.95 75.63 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.817 -1.083 . . . . 1.73 109.734 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 12.6 pttt -93.89 -31.22 14.41 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.757 0.651 . . . . 2.47 112.757 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 72' ' ' ASN . 0.9 OUTLIER -97.28 19.97 12.26 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.838 0.31 . . . . 2.68 111.838 -174.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.661 HG23 HD11 ' A' ' 80' ' ' ILE . 4.1 t -68.44 120.2 73.48 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 109.118 -0.697 . . . . 1.46 109.118 172.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.515 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 9.3 Cg_exo -71.8 -9.47 24.87 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 123.077 2.518 . . . . 1.2 114.029 -166.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 77.3 p -111.23 1.25 17.09 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.118 0.414 . . . . 1.84 112.118 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.661 HD11 HG23 ' A' ' 77' ' ' THR . 47.3 mt -119.93 140.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 1.93 111.493 -175.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.3 t -82.46 154.75 24.97 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.566 0.698 . . . . 2.06 111.003 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.413 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 27.9 tt0 -60.71 -34.06 73.81 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.466 -1.243 . . . . 2.89 113.182 -167.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -63.0 -46.91 85.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.842 0.312 . . . . 2.06 111.842 -175.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.96 -32.55 72.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.209 0.528 . . . . 2.93 109.997 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.657 HD11 ' O ' ' A' ' 74' ' ' LEU . 30.8 mm -61.57 -44.93 99.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.169 -0.923 . . . . 2.15 110.963 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.562 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 36.4 ttpt -57.25 -40.69 78.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.505 -0.77 . . . . 2.96 111.516 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.92 -31.34 72.53 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.778 -0.646 . . . . 1.7 110.971 -174.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.443 HD11 HD23 ' A' ' 74' ' ' LEU . 44.8 mt -70.0 -71.37 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.601 0.593 . . . . 1.21 112.601 -175.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.654 ' HD1' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -110.57 -15.7 13.82 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.419 0.896 . . . . 1.16 113.419 -168.368 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.562 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 81.7 t80 -71.58 -27.32 63.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.378 0.608 . . . . 1.66 110.614 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 43.2 mt . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.467 -0.788 . . . . 1.23 111.174 -178.808 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 121.813 0.816 . . . . 1.79 110.69 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.2 m -72.28 130.37 40.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.317 -0.856 . . . . 1.67 110.27 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.552 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 52.5 mt-30 -47.91 -47.6 32.11 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.275 0.843 . . . . 2.09 113.275 -169.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -67.69 -39.15 84.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.751 0.31 . . . . 2.17 111.259 -176.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -70.11 -36.43 74.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.429 -0.35 . . . . 3.07 110.576 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 85.9 t -58.14 -41.38 80.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.194 -0.457 . . . . 0.39 110.794 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -44.27 82.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.029 0.443 . . . . 1.1 111.157 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.06 -33.78 72.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.977 -0.556 . . . . 0.86 110.203 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -63.01 -43.9 97.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.645 -0.707 . . . . 2.05 110.647 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.69 HD11 HD13 ' A' ' 43' ' ' LEU . 5.0 mm -64.72 -51.0 72.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 N-CA-C 109.894 -0.41 . . . . 1.05 109.894 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.448 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 16.3 p -62.98 -40.55 98.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.39 111.267 -174.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -61.92 -45.16 94.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.7 111.178 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -74.2 -34.23 63.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.748 0.308 . . . . 3.55 111.785 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.459 ' HB3' ' HA3' ' A' ' 67' ' ' GLY . 29.1 mt -82.49 -13.84 56.01 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.441 -0.345 . . . . 1.66 111.915 -176.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 61.51 32.04 18.85 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 108.333 -0.988 . . . . 2.19 108.333 -170.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.725 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 7.6 tp10 -59.39 116.44 16.29 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 114.135 -1.393 . . . . 1.67 112.171 -172.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.5 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 59.9 Cg_endo -67.07 -46.58 2.99 Favored 'Trans proline' 0 N--CA 1.472 0.26 0 C-N-CA 124.066 3.177 . . . . 0.41 113.049 173.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.502 ' HZ3' ' HG ' ' A' ' 26' ' ' LEU . 41.7 pttt -100.88 67.91 1.25 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.737 0.779 . . . . 2.03 109.894 -175.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.33 -17.95 56.25 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.128 -0.942 . . . . 2.27 112.255 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -57.54 -40.74 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 2.14 110.182 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.666 HD23 ' HA ' ' A' ' 89' ' ' PHE . 3.2 tm? -73.02 -45.52 57.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.396 -0.82 . . . . 2.02 110.334 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.725 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.0 tp -68.05 -28.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.997 -0.547 . . . . 1.18 111.083 -175.022 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.631 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.45 -34.67 60.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.41 . . . . 1.03 110.563 172.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -63.08 -45.98 89.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 1.96 111.476 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.5 p -55.64 -38.69 51.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.094 0.473 . . . . 1.15 109.878 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.631 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 65.3 t -54.87 -50.64 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.167 -0.924 . . . . 0.22 110.571 173.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.09 -40.81 95.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.141 -0.936 . . . . 4.21 110.959 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 39.1 mm -74.42 -48.54 35.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 115.993 -0.549 . . . . 1.5 112.236 -175.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.0 pt -91.33 -29.1 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 120.379 -0.529 . . . . 1.12 112.288 -174.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.15 161.88 11.83 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.561 -0.828 . . . . 0.28 112.612 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.552 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 2.5 p-10 -65.07 -52.67 54.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.785 0.326 . . . . 0.99 111.72 -178.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -71.63 -32.9 68.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.924 0.392 . . . . 3.52 110.396 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -67.8 -29.91 69.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 3.03 111.056 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.69 -39.99 84.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 0.89 110.178 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 30.2 mt -69.34 -32.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.517 . . . . 1.78 110.911 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -58.72 -38.55 78.58 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.099 -0.334 . . . . 2.1 110.099 173.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.831 ' HB3' HD12 ' A' ' 73' ' ' LEU . 68.4 mt -71.41 -35.2 70.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.431 -0.35 . . . . 1.09 110.204 174.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.69 HD13 HD11 ' A' ' 15' ' ' ILE . 41.1 mt -63.99 -29.93 71.05 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.201 0.524 . . . . 2.0 111.545 176.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.8 tpp -75.97 -35.32 59.7 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.327 0.584 . . . . 2.68 109.684 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -69.87 -34.38 73.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.292 -0.867 . . . . 1.83 111.501 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 1.057 HG22 HD13 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -52.0 -36.61 50.42 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 112.097 0.406 . . . . 1.5 112.097 -176.451 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.51 85.4 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.628 0.233 . . . . 1.4 111.628 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.45 -30.6 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.402 0.62 . . . . 2.51 110.276 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.1 t -76.38 -44.86 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.363 -0.835 . . . . 0.76 110.546 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -56.14 -49.03 75.08 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.225 -0.898 . . . . 1.96 112.218 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -60.75 -29.37 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 2.48 111.906 -173.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.75 -25.22 19.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.976 0.417 . . . . 2.4 111.636 -177.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.08 -14.63 18.97 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.21 -0.519 . . . . 1.65 112.104 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 40.31 -81.91 0.0 OUTLIER Glycine 0 CA--C 1.528 0.899 0 N-CA-C 117.657 1.823 . . . . 1.25 117.657 167.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.753 ' HB3' ' HA ' ' A' ' 64' ' ' ARG . 2.8 tm? -74.85 132.01 41.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 115.252 1.575 . . . . 2.02 115.252 -156.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.553 ' N ' HD21 ' A' ' 55' ' ' LEU . 74.3 t80 -123.34 114.19 19.85 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.425 -1.261 . . . . 3.65 107.644 159.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.688 ' CG2' HD13 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -87.61 -172.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 114.125 1.158 . . . . 1.28 114.125 -168.611 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.39 -47.26 76.12 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 115.174 -0.921 . . . . 1.44 112.754 -172.056 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.705 HD21 ' N ' ' A' ' 60' ' ' GLY . 0.3 OUTLIER -91.62 -27.72 17.96 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 119.776 -0.77 . . . . 2.28 111.468 176.604 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . 0.705 ' N ' HD21 ' A' ' 59' ' ' ASN . . . 82.61 -13.44 41.71 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.904 -0.665 . . . . 1.21 113.768 176.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.2 m -46.37 -58.48 3.69 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 122.89 0.476 . . . . 2.35 111.833 -177.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.5 ptp180 -99.89 104.71 16.38 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.223 -0.658 . . . . 3.36 109.223 173.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -72.57 127.18 31.78 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.563 -0.455 . . . . 4.14 110.502 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.753 ' HA ' ' HB3' ' A' ' 55' ' ' LEU . 8.9 tpt85 71.22 98.74 0.07 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.968 -1.014 . . . . 2.6 112.814 175.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 1.016 HG21 ' HA2' ' A' ' 68' ' ' GLY . 1.1 t -109.31 147.85 36.83 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 114.268 -1.333 . . . . 1.26 108.862 168.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -51.51 -59.05 1.27 Allowed 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.124 2.55 . . . . 0.51 113.076 -175.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.58 ' O ' HD22 ' A' ' 71' ' ' LEU . . . -66.22 -36.27 91.55 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.294 -0.955 . . . . 0.29 110.721 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 1.016 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.18 -32.06 59.74 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.911 -0.645 . . . . 0.32 112.927 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.639 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 0.4 OUTLIER -65.26 -32.57 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 117.459 0.63 . . . . 0.74 110.101 -178.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.576 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 18.6 t80 -67.42 -37.67 83.41 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.571 -0.529 . . . . 0.31 109.571 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.58 HD22 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -62.37 -34.78 77.36 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.381 -1.34 . . . . 1.14 107.381 176.549 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.649 ' HB2' HD22 ' A' ' 55' ' ' LEU . 65.7 t30 -59.67 -31.4 69.51 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 115.19 -0.914 . . . . 1.14 109.852 175.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 1.057 HD13 HG22 ' A' ' 46' ' ' THR . 87.8 mt -62.02 -33.1 73.73 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 115.683 -0.69 . . . . 1.07 111.956 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.568 ' O ' HD11 ' A' ' 85' ' ' ILE . 42.1 mt -64.32 -21.28 66.56 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.381 -0.528 . . . . 1.73 110.395 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.521 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -85.19 -15.29 44.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 2.47 110.641 173.468 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -115.02 4.45 14.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 2.68 111.428 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.564 HG21 ' HB ' ' A' ' 80' ' ' ILE . 9.7 t -72.93 114.34 29.82 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 121.758 0.79 . . . . 1.46 109.968 -175.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 6.2 Cg_exo -72.94 -22.16 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 123.039 2.492 . . . . 1.2 113.499 -165.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 30.2 m -112.85 17.4 19.01 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.09 0.774 . . . . 1.84 113.09 -173.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.564 ' HB ' HG21 ' A' ' 77' ' ' THR . 41.0 mm -118.3 135.9 57.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.115 0.484 . . . . 1.93 111.724 -177.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.3 p -75.89 148.91 37.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.743 -0.662 . . . . 2.06 110.344 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -57.06 -34.48 68.3 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.848 -1.069 . . . . 2.89 112.962 -169.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -70.29 -42.69 71.72 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.144 -0.222 . . . . 2.06 111.309 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -60.93 -34.46 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.934 0.397 . . . . 2.93 110.13 177.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.568 HD11 ' O ' ' A' ' 74' ' ' LEU . 60.4 mt -60.69 -51.15 76.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 2.15 110.049 175.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.539 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 27.1 ttpt -54.64 -42.47 71.29 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.831 -0.622 . . . . 2.96 110.512 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.44 -35.96 79.03 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.183 -0.917 . . . . 1.7 111.714 -175.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 62.9 mt -70.94 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 112.273 0.471 . . . . 1.21 112.273 -177.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.666 ' HA ' HD23 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -103.4 -18.9 14.63 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.613 0.968 . . . . 1.16 113.613 -166.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.539 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 60.4 t80 -77.05 -38.94 51.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.864 0.364 . . . . 1.66 110.632 -175.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 43.4 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.251 0.548 . . . . 1.23 110.843 -179.451 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 . . . . . 0 N--CA 1.451 -0.376 0 CA-C-O 122.032 0.92 . . . . 1.79 109.33 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 14.8 m -58.95 128.55 37.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.873 -1.058 . . . . 1.67 110.242 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.805 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 49.9 mt-30 -53.23 -34.15 55.91 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.551 -0.75 . . . . 2.09 112.229 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.2 -48.21 68.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.833 0.349 . . . . 2.17 110.529 178.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -70.1 -35.85 74.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 3.07 110.727 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 75.0 t -57.88 -56.49 15.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.05 -0.352 . . . . 0.39 110.05 176.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.43 -37.82 70.73 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.356 0.598 . . . . 1.1 110.962 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -61.57 -39.07 89.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.284 -0.871 . . . . 0.86 111.161 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -77.78 -41.2 38.21 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.034 0.383 . . . . 2.05 112.034 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.0 mm -55.91 -50.85 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.029 0.443 . . . . 1.05 110.336 -175.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.615 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 7.8 p -57.59 -39.59 77.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.396 -0.82 . . . . 0.39 111.313 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -66.46 -45.58 79.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.116 -0.493 . . . . 0.7 110.88 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 34.2 mtp180 -65.42 -43.21 91.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.91 -0.586 . . . . 3.55 111.723 -175.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.59 HD11 ' HA3' ' A' ' 67' ' ' GLY . 3.3 mm? -83.05 -7.57 59.64 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.14 0.422 . . . . 1.66 112.14 -178.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 56.16 37.18 28.58 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.009 -1.108 . . . . 2.19 108.009 -169.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.794 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 5.5 tp10 -60.84 117.02 21.37 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 113.168 -1.833 . . . . 1.67 111.309 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 48.9 Cg_endo -64.16 -44.17 13.02 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 123.708 2.939 . . . . 0.41 112.862 174.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.539 ' HG3' ' OE2' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -104.49 72.37 1.04 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.74 1.257 . . . . 2.03 110.014 -175.792 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -66.12 -18.38 65.31 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.565 -1.652 . . . . 2.27 112.707 -167.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.21 -33.08 69.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.124 0.487 . . . . 2.14 109.732 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.887 HD13 ' HA ' ' A' ' 89' ' ' PHE . 8.7 tt -73.95 -40.51 63.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 2.02 110.26 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.794 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.9 tp -62.97 -29.73 47.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.651 -0.499 . . . . 1.18 109.651 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.668 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.37 -34.74 63.42 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.403 0.62 . . . . 1.03 110.285 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.9 ttm180 -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.556 -0.747 . . . . 1.96 111.125 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 19.9 t -53.22 -46.37 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 N-CA-C 109.114 -0.698 . . . . 1.15 109.114 176.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.668 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -52.84 -50.33 43.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.153 -1.385 . . . . 0.22 111.337 175.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 -61.02 -49.7 76.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.733 -0.667 . . . . 4.21 111.627 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 35.8 mt -73.89 -51.94 22.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.713 0.634 . . . . 1.5 112.713 -171.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.8 pt -83.81 -28.68 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.058 -0.657 . . . . 1.12 111.328 -176.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.97 149.8 8.64 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.596 -0.811 . . . . 0.28 111.66 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.805 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 1.6 p-10 -60.32 -41.34 93.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.078 0.399 . . . . 0.99 112.078 -177.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -71.79 -34.81 69.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.005 0.431 . . . . 3.52 110.237 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.839 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 21.5 mtpp -69.69 -25.03 63.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.122 -0.49 . . . . 3.03 110.992 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.64 -36.42 80.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.199 0.523 . . . . 0.89 109.606 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.41 -40.78 64.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.588 -0.733 . . . . 1.78 111.441 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.839 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 12.8 pt-20 -67.17 -31.81 72.48 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.726 -0.39 . . . . 2.1 110.443 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.797 ' HB3' HD12 ' A' ' 73' ' ' LEU . 28.6 mt -69.39 -41.91 75.84 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.349 -0.612 . . . . 1.09 109.349 171.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.415 ' HA ' HD11 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -56.62 -32.85 65.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.811 -0.631 . . . . 2.0 111.808 -179.734 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 80.1 mtp -75.31 -42.36 54.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.136 0.493 . . . . 2.68 110.353 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -70.23 -25.05 63.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.799 -0.637 . . . . 1.83 111.369 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.584 HG22 HD13 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -56.04 -36.73 68.34 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 110.087 -0.338 . . . . 1.5 110.087 178.505 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.54 -34.4 77.83 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.075 -0.511 . . . . 1.4 110.975 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 43.9 mt-10 -71.12 -42.82 68.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.925 -0.58 . . . . 2.51 110.059 178.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.63 -33.39 63.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.013 -0.54 . . . . 0.76 109.813 176.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.434 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 3.7 tm-20 -61.66 -51.25 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.489 -0.778 . . . . 1.96 109.662 175.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.626 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.8 pt20 -64.84 -18.0 64.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.861 0.362 . . . . 2.48 111.3 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -99.06 -7.88 26.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.546 -0.297 . . . . 2.4 111.696 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.24 35.55 91.72 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 121.176 -0.535 . . . . 1.65 112.81 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -97.16 109.27 3.81 Favored Glycine 0 C--O 1.226 -0.358 0 C-N-CA 120.598 -0.81 . . . . 1.25 113.785 -174.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.866 HD22 ' HB2' ' A' ' 72' ' ' ASN . 2.6 tm? -176.82 124.47 0.15 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.122 0.487 . . . . 2.02 110.836 169.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.451 ' N ' HD21 ' A' ' 55' ' ' LEU . 97.2 m-85 -126.0 100.89 6.55 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.132 -1.062 . . . . 3.65 108.132 164.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.558 HD12 HG23 ' A' ' 65' ' ' THR . 0.5 OUTLIER -72.03 -176.15 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.012 0.375 . . . . 1.28 112.012 -176.687 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -41.22 -45.61 2.92 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.912 -1.04 . . . . 1.44 112.573 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.581 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 0.1 OUTLIER -94.92 -34.88 12.24 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.551 0.575 . . . . 2.28 112.551 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.75 -17.08 32.77 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.422 -0.418 . . . . 1.21 113.181 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.581 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 68.6 m -64.12 -57.61 9.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.689 0.281 . . . . 2.35 111.683 -178.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -81.59 81.55 7.63 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.907 -0.775 . . . . 3.36 108.907 174.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -71.41 126.96 31.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.774 -0.648 . . . . 4.14 111.167 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.482 ' H ' HD11 ' A' ' 55' ' ' LEU . 0.1 OUTLIER 70.08 58.0 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.703 1.001 . . . . 2.6 113.703 172.618 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.797 HG21 ' HA2' ' A' ' 68' ' ' GLY . 3.7 t -78.64 143.33 62.95 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.221 -0.9 . . . . 1.26 109.152 169.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.423 ' O ' HD11 ' A' ' 19' ' ' LEU . 9.3 Cg_endo -46.25 -59.61 1.15 Allowed 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 124.134 3.222 . . . . 0.51 113.477 -174.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.59 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -68.25 -34.55 80.74 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.329 -0.939 . . . . 0.29 111.316 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.797 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.31 -38.65 79.58 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 114.981 -0.61 . . . . 0.32 112.114 177.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.0 t -59.67 -41.44 85.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.129 0.49 . . . . 0.74 110.204 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.634 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 21.1 t80 -65.73 -36.83 84.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.31 110.484 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.744 HD11 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -57.63 -36.77 72.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.755 -0.831 . . . . 1.14 108.755 176.819 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.866 ' HB2' HD22 ' A' ' 55' ' ' LEU . 66.5 t30 -63.05 -27.7 69.59 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.453 -0.794 . . . . 1.14 110.549 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.797 HD12 ' HB3' ' A' ' 42' ' ' LEU . 45.5 mt -58.22 -35.41 71.63 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.148 -0.478 . . . . 1.07 111.763 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.498 ' HB3' ' CG2' ' A' ' 85' ' ' ILE . 7.2 mp -64.4 -19.78 65.72 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.089 -0.505 . . . . 1.73 110.616 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.403 ' N ' ' HE2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -82.66 -40.11 21.16 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.927 0.394 . . . . 2.47 110.151 175.655 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -89.04 11.19 19.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.775 -0.648 . . . . 2.68 110.872 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.56 HG23 ' HB ' ' A' ' 80' ' ' ILE . 14.7 t -64.28 131.79 95.14 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 121.752 0.787 . . . . 1.46 109.946 -177.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.5 Cg_exo -72.72 -47.5 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.284 2.656 . . . . 1.2 113.851 -169.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.2 m -113.53 16.76 18.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.499 0.926 . . . . 1.84 113.499 -172.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.56 ' HB ' HG23 ' A' ' 77' ' ' THR . 61.4 mt -119.1 138.92 48.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.57 -0.452 . . . . 1.93 111.172 -174.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.3 p -98.28 167.2 11.0 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.063 0.458 . . . . 2.06 111.861 -177.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -51.9 -48.64 64.04 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.14 1.163 . . . . 2.89 114.14 -167.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -68.07 -37.09 80.86 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.567 -0.453 . . . . 2.06 111.796 -173.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -62.22 -37.19 84.41 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.542 0.687 . . . . 2.93 109.26 175.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.498 ' CG2' ' HB3' ' A' ' 74' ' ' LEU . 82.4 mt -68.39 -49.49 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 114.637 -1.165 . . . . 2.15 110.934 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.533 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 39.3 ttmt -57.25 -41.45 79.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.887 -0.597 . . . . 2.96 111.538 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.11 -32.92 71.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.005 0.431 . . . . 1.7 111.161 -177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 51.8 mt -70.83 -70.84 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.941 -0.572 . . . . 1.21 112.318 -177.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.887 ' HA ' HD13 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -106.89 -12.9 15.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 113.254 0.835 . . . . 1.16 113.254 -164.585 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.533 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 76.3 t80 -90.28 -38.14 13.6 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.793 0.33 . . . . 1.66 110.911 -172.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 51.4 mt . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 116.426 -0.352 . . . . 1.23 110.423 178.234 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.325 -0.62 . . . . 1.79 109.325 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.1 t -63.31 119.23 9.25 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.648 -0.501 . . . . 1.67 109.648 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.806 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 16.1 mt-30 -55.87 -29.89 60.66 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.346 0.498 . . . . 2.09 112.346 -173.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -65.38 -50.17 66.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.084 0.469 . . . . 2.17 110.287 176.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . 0.539 ' HE3' ' HB3' ' A' ' 13' ' ' ASP . 0.3 OUTLIER -70.25 -37.45 74.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.918 -0.583 . . . . 3.07 109.885 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.5 t -57.14 -47.62 83.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.228 -0.286 . . . . 0.39 110.228 177.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.23 -42.86 70.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.206 0.527 . . . . 1.1 111.029 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.539 ' HB3' ' HE3' ' A' ' 10' ' ' LYS . 35.8 t70 -70.37 -39.73 74.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.687 -0.688 . . . . 0.86 110.537 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -61.46 -45.2 95.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.118 -0.947 . . . . 2.05 111.292 -177.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.551 ' CD1' HD23 ' A' ' 43' ' ' LEU . 5.2 mm -59.98 -52.17 64.33 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-O 121.067 0.461 . . . . 1.05 109.925 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.49 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 19.4 p -64.95 -38.88 92.45 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.642 -0.708 . . . . 0.39 111.32 -175.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -59.23 -45.61 90.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.783 -0.644 . . . . 0.7 110.949 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -79.04 -33.7 44.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.603 -0.272 . . . . 3.55 111.529 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.953 HD11 ' HA3' ' A' ' 67' ' ' GLY . 4.2 mm? -79.29 -9.4 59.57 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.445 0.535 . . . . 1.66 112.445 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 58.57 34.65 24.03 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 108.079 -1.082 . . . . 2.19 108.079 -171.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.525 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 1.3 tm-20 -71.8 126.07 91.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 114.089 -1.414 . . . . 1.67 111.91 -165.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.422 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 73.6 Cg_endo -69.93 -46.65 1.08 Allowed 'Trans proline' 0 N--CA 1.476 0.463 0 C-N-CA 124.657 3.571 . . . . 0.41 114.345 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.422 ' HG2' ' HG2' ' A' ' 22' ' ' PRO . 33.0 pttt -109.85 66.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.382 0.611 . . . . 2.03 110.494 -169.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -59.32 -12.44 5.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.523 -1.217 . . . . 2.27 113.411 -167.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.13 -46.61 86.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.374 0.607 . . . . 2.14 109.662 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 89' ' ' PHE . 6.6 tt -73.36 -41.57 63.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.289 -0.868 . . . . 2.02 110.812 -177.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.525 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 6.4 tp -65.87 -30.04 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 121.004 0.43 . . . . 1.18 110.413 -177.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.713 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.18 -33.82 63.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.579 0.704 . . . . 1.03 110.333 173.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -63.03 -39.15 93.89 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.296 -0.865 . . . . 1.96 111.763 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 23.1 t -52.78 -43.16 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.128 -0.693 . . . . 1.15 109.128 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.713 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.0 t -53.18 -50.07 48.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.278 -1.328 . . . . 0.22 110.855 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -59.49 -43.82 93.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.22 -0.9 . . . . 4.21 111.429 -177.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 38.9 mm -75.55 -49.73 26.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.672 . . . . 1.5 112.5 -173.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.43 ' O ' ' HG3' ' A' ' 38' ' ' LYS . 36.4 pt -94.76 -29.07 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.604 0.594 . . . . 1.12 112.604 -172.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.33 162.17 10.81 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.556 -0.83 . . . . 0.28 112.673 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.806 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 20.4 p-10 -67.59 -55.99 11.21 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.515 0.326 . . . . 0.99 111.667 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.56 -33.85 69.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.869 -0.419 . . . . 3.52 109.869 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.43 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 5.9 mmmm -56.83 -38.3 72.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.855 -0.611 . . . . 3.03 110.914 176.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.441 ' O ' HD21 ' A' ' 43' ' ' LEU . . . -71.42 -38.85 71.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.89 110.869 177.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.793 ' HA ' HD22 ' A' ' 43' ' ' LEU . 22.3 mt -71.42 -33.26 49.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.45 -0.341 . . . . 1.78 111.308 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.46 -33.76 74.3 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.995 0.426 . . . . 2.1 110.179 173.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.823 HD21 ' HB3' ' A' ' 73' ' ' LEU . 79.0 mt -62.73 -36.7 83.84 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.914 -0.585 . . . . 1.09 110.47 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.793 HD22 ' HA ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -57.47 -32.73 67.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.575 0.226 . . . . 2.0 111.036 178.222 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 78.7 mmm -71.41 -39.52 71.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.993 0.425 . . . . 2.68 110.544 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.88 -24.46 62.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.129 -0.487 . . . . 1.83 111.886 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.59 HG23 HD13 ' A' ' 73' ' ' LEU . 43.1 p -54.47 -42.36 70.6 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.55 -0.46 . . . . 1.5 109.877 175.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.25 -39.99 76.72 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.107 -0.497 . . . . 1.4 111.032 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.86 -46.91 85.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.629 -0.714 . . . . 2.51 110.655 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 47.5 t -76.4 -32.08 21.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.339 -0.392 . . . . 0.76 111.263 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.873 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 22.2 mt-10 -67.35 -38.94 85.63 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.913 0.338 . . . . 1.96 111.913 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.07 -19.05 62.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.852 0.358 . . . . 2.48 111.224 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -106.31 -25.06 12.1 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.286 -0.415 . . . . 2.4 112.088 -176.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.86 50.21 9.23 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 116.007 -0.542 . . . . 1.65 113.6 174.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -109.7 118.43 5.13 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.123 -1.036 . . . . 1.25 114.606 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.738 ' HB3' ' HA ' ' A' ' 64' ' ' ARG . 46.6 tp -177.97 131.63 0.15 Allowed 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.471 0.545 . . . . 2.02 112.471 168.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -124.65 101.52 7.16 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.107 -1.071 . . . . 3.65 108.107 165.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.531 HD12 ' O ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -68.85 -167.23 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 113.595 0.961 . . . . 1.28 113.595 -169.422 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -41.58 -48.01 3.94 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.534 -1.212 . . . . 1.44 111.52 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.539 HD21 ' N ' ' A' ' 61' ' ' SER . 4.2 t30 -116.02 -37.01 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.41 . . . . 2.28 111.008 173.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 98.69 8.02 54.91 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.23 -0.986 . . . . 1.21 111.354 -171.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.539 ' N ' HD21 ' A' ' 59' ' ' ASN . 5.3 p -54.66 -53.7 51.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.319 0.58 . . . . 2.35 110.867 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.531 ' O ' HD12 ' A' ' 57' ' ' ILE . 5.0 ptp180 -112.12 53.58 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.6 -0.889 . . . . 3.36 108.6 171.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . 0.452 ' HA ' ' CG1' ' A' ' 57' ' ' ILE . 14.9 ptp180 -50.36 132.42 24.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.786 -1.097 . . . . 4.14 112.211 -168.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.873 ' NH2' ' HA ' ' A' ' 50' ' ' GLU . 19.3 tpt85 68.26 44.82 1.32 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.992 0.901 . . . . 2.6 111.251 174.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.673 HG21 ' HA2' ' A' ' 68' ' ' GLY . 4.7 t -74.14 144.01 81.25 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.891 -1.049 . . . . 1.26 110.176 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -46.27 -59.54 1.18 Allowed 'Trans proline' 0 N--CA 1.485 1.016 0 C-N-CA 124.365 3.377 . . . . 0.51 113.883 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.953 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -66.97 -35.3 89.25 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.267 -0.968 . . . . 0.29 111.115 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.673 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -58.33 -32.61 68.37 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.821 -0.689 . . . . 0.32 112.227 176.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.47 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 17.1 t -63.71 -35.04 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 CA-C-O 121.223 0.535 . . . . 0.74 110.561 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.6 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 14.5 t80 -65.29 -35.6 81.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.887 -0.597 . . . . 0.31 109.813 174.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.571 ' N ' HD21 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -60.21 -34.8 74.15 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.961 -1.125 . . . . 1.14 107.961 177.228 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.685 ' HB2' HD12 ' A' ' 55' ' ' LEU . 54.1 t30 -63.08 -27.13 69.18 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.326 -0.852 . . . . 1.14 110.072 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.823 ' HB3' HD21 ' A' ' 42' ' ' LEU . 67.7 mt -61.05 -33.4 73.24 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.834 -0.621 . . . . 1.07 111.253 175.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.721 ' HB3' HD13 ' A' ' 85' ' ' ILE . 8.4 mp -63.98 -20.38 65.85 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.143 -0.48 . . . . 1.73 109.983 175.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.461 ' HZ3' ' CG2' ' A' ' 85' ' ' ILE . 0.0 OUTLIER -85.11 -45.26 12.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.363 0.602 . . . . 2.47 109.837 172.046 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -81.58 9.11 8.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.133 -0.94 . . . . 2.68 111.379 -176.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.612 ' CG2' ' HB ' ' A' ' 80' ' ' ILE . 9.9 t -68.47 122.47 84.64 Favored Pre-proline 0 N--CA 1.446 -0.668 0 N-CA-C 108.899 -0.778 . . . . 1.46 108.899 176.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 21.1 Cg_exo -65.87 -39.33 20.12 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.839 2.36 . . . . 1.2 113.629 -164.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 19.5 m -113.23 5.66 17.07 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.298 0.851 . . . . 1.84 113.298 -175.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.612 ' HB ' ' CG2' ' A' ' 77' ' ' THR . 62.7 mt -113.24 138.94 41.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 121.862 -0.524 . . . . 1.93 111.283 -174.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.2 p -97.12 155.15 16.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.436 0.636 . . . . 2.06 111.656 -177.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 57.3 mm-40 -59.37 -27.03 65.59 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.076 1.139 . . . . 2.89 114.076 -171.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.85 -43.92 86.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.676 0.671 . . . . 2.06 110.916 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -67.36 -26.52 66.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.79 0.805 . . . . 2.93 109.157 177.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.721 HD13 ' HB3' ' A' ' 74' ' ' LEU . 51.1 mm -75.9 -38.92 37.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.464 -1.244 . . . . 2.15 112.113 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 82' ' ' GLU . 8.0 mttm -57.7 -43.29 85.07 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 108.71 -0.848 . . . . 2.96 108.71 177.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -59.32 -32.89 70.49 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.885 -1.507 . . . . 1.7 109.862 -175.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 49.1 mt -71.94 -64.94 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.995 -1.002 . . . . 1.21 112.22 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.722 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -108.32 -19.05 13.6 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 114.77 1.396 . . . . 1.16 114.77 -167.368 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.722 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 89.3 t80 -76.88 -34.11 57.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.396 0.543 . . . . 1.66 110.454 -174.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.6 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.054 -0.521 . . . . 1.23 110.325 178.423 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 121.933 0.873 . . . . 1.79 109.303 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -73.94 139.6 45.01 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.783 -0.821 . . . . 1.67 108.783 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.6 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 61.2 mt-30 -48.54 -45.77 37.9 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.974 0.731 . . . . 2.09 112.974 -169.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -63.67 -42.76 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 2.17 110.706 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -70.39 -37.13 74.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.04 0.448 . . . . 3.07 110.044 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.595 ' CG1' HD12 ' A' ' 15' ' ' ILE . 49.3 t -56.66 -51.91 60.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.634 -0.712 . . . . 0.39 110.865 177.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.18 -33.94 59.31 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.156 0.503 . . . . 1.1 111.206 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -70.38 -41.66 72.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.824 -0.625 . . . . 0.86 110.789 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -72.89 -42.63 63.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.372 -0.376 . . . . 2.05 111.597 -175.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.841 HD13 HD22 ' A' ' 43' ' ' LEU . 1.3 mm -58.68 -48.04 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 120.34 -0.544 . . . . 1.05 110.209 -177.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . 0.619 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 21.7 p -64.57 -34.61 78.67 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.667 -0.697 . . . . 0.39 110.899 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -68.49 -44.06 75.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.196 -0.457 . . . . 0.7 110.481 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -69.46 -46.28 67.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.906 -0.588 . . . . 3.55 111.72 -176.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.85 HD11 ' HA3' ' A' ' 67' ' ' GLY . 4.2 mm? -85.1 1.43 47.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.087 0.402 . . . . 1.66 112.087 -175.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 55.68 33.17 20.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.241 0.543 . . . . 2.19 109.561 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.693 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.08 116.77 18.77 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 114.623 -1.171 . . . . 1.67 112.694 -168.031 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.456 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 52.5 Cg_endo -63.45 -40.26 32.15 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 124.011 3.141 . . . . 0.41 113.33 172.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.486 ' HG3' ' OE1' ' A' ' 21' ' ' GLU . 41.9 pttt -109.0 68.56 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.824 0.821 . . . . 2.03 109.463 -172.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -62.77 -12.56 24.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.68 -1.146 . . . . 2.27 113.542 -166.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -75.42 -33.85 60.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.117 0.484 . . . . 2.14 110.115 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.628 HD13 ' HA ' ' A' ' 89' ' ' PHE . 0.6 OUTLIER -73.57 -47.33 41.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 2.02 110.171 -178.548 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.693 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 11.0 tp -62.97 -29.43 47.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.216 -0.447 . . . . 1.18 110.895 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.664 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.94 -33.42 63.91 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.061 0.457 . . . . 1.03 110.673 174.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.441 ' CD ' ' HA ' ' A' ' 88' ' ' ILE . 14.0 ttm180 -58.15 -40.15 80.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.032 -0.531 . . . . 1.96 110.874 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 23.3 t -53.06 -44.7 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.487 0.66 . . . . 1.15 109.535 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.664 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 82.0 t -52.95 -50.37 44.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 114.19 -1.368 . . . . 0.22 111.149 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -66.07 -41.92 90.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.298 -0.865 . . . . 4.21 111.14 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 50.1 mm -74.67 -50.27 26.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.897 -0.592 . . . . 1.5 112.541 -172.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.1 pt -95.56 -29.49 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.106 -0.638 . . . . 1.12 111.902 -174.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.33 160.81 10.98 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.401 -0.904 . . . . 0.28 112.651 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.6 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 3.0 p-10 -67.84 -48.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.49 0.186 . . . . 0.99 111.409 -177.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.404 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 19.4 ptmt -71.73 -33.09 68.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.067 0.461 . . . . 3.52 109.876 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -64.31 -32.2 73.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.016 -0.538 . . . . 3.03 109.844 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.24 -42.52 75.53 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.869 -0.605 . . . . 0.89 109.991 173.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.751 ' HA ' ' HG ' ' A' ' 43' ' ' LEU . 44.8 mm -59.96 -37.68 73.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 120.921 0.391 . . . . 1.78 110.672 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 14.4 mm-40 -54.33 -46.45 72.9 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.236 -0.653 . . . . 2.1 109.236 173.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.929 HD23 ' HB3' ' A' ' 73' ' ' LEU . 72.2 mt -65.63 -43.18 90.29 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.268 -0.878 . . . . 1.09 111.279 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.841 HD22 HD13 ' A' ' 15' ' ' ILE . 4.8 mt -56.68 -38.74 72.65 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.024 0.44 . . . . 2.0 110.334 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 tpp -74.69 -39.78 61.77 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.215 -0.448 . . . . 2.68 109.926 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 40.6 mt-10 -70.01 -23.69 63.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.721 -0.672 . . . . 1.83 112.172 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.533 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 71.6 p -51.1 -49.11 61.35 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.715 0.293 . . . . 1.5 110.25 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.62 82.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.724 -0.671 . . . . 1.4 111.481 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 36.6 mt-10 -66.94 -40.22 87.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.153 0.502 . . . . 2.51 110.389 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -76.85 -33.51 21.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.065 -0.516 . . . . 0.76 110.495 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' A' ' 46' ' ' THR . 40.5 mt-10 -58.44 -51.47 69.71 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.344 -0.389 . . . . 1.96 111.27 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 5.3 pp0? -63.72 -22.76 67.07 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 123.371 0.419 . . . . 2.48 111.085 -176.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -89.47 -12.65 39.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.341 0.591 . . . . 2.4 110.394 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.45 28.93 64.75 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.673 -0.694 . . . . 1.65 112.488 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.408 ' O ' ' HB2' ' A' ' 55' ' ' LEU . . . -89.48 101.27 2.75 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.678 -0.772 . . . . 1.25 113.889 -174.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.817 HD21 ' HB2' ' A' ' 72' ' ' ASN . 2.7 tm? -176.62 124.57 0.17 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.102 0.477 . . . . 2.02 111.268 170.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -124.6 105.03 9.04 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.24 -1.022 . . . . 3.65 108.24 164.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.682 ' CG2' HD12 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -77.5 -179.45 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 112.583 0.586 . . . . 1.28 112.583 -171.02 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.47 -43.93 65.28 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.778 -0.646 . . . . 1.44 111.481 -176.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -90.49 -37.54 13.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 2.28 110.989 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 83.75 -14.87 39.83 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.163 -0.541 . . . . 1.21 112.703 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -57.78 11.51 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.892 0.377 . . . . 2.35 111.253 -176.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.466 ' O ' HD12 ' A' ' 57' ' ' ILE . 7.8 ptp180 -96.41 55.69 1.5 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.536 0.684 . . . . 3.36 109.605 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.5 ptt180 -53.89 146.36 14.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.127 -0.942 . . . . 4.14 111.795 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.557 ' H ' HD13 ' A' ' 55' ' ' LEU . 0.0 OUTLIER 61.95 49.83 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.629 -1.169 . . . . 2.6 112.621 -177.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.857 HG21 ' HA2' ' A' ' 68' ' ' GLY . 1.8 t -75.51 142.01 73.78 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.256 -0.883 . . . . 1.26 109.457 169.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -47.31 -59.12 1.37 Allowed 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 123.831 3.021 . . . . 0.51 112.808 -175.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.85 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.65 -39.19 97.59 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.018 -0.833 . . . . 0.29 111.018 177.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.857 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.79 -31.97 61.44 Favored Glycine 0 N--CA 1.447 -0.579 0 CA-C-N 114.866 -0.667 . . . . 0.32 112.868 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.0 t -66.13 -38.33 81.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.124 0.487 . . . . 0.74 109.891 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.514 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 5.9 t80 -66.41 -38.69 88.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.162 -0.472 . . . . 0.31 109.932 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.693 HD21 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -57.0 -34.52 68.23 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.83 -0.804 . . . . 1.14 108.83 176.19 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.817 ' HB2' HD21 ' A' ' 55' ' ' LEU . 6.0 t30 -59.59 -38.94 82.56 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.559 -0.746 . . . . 1.14 110.154 176.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.929 ' HB3' HD23 ' A' ' 42' ' ' LEU . 70.9 mt -58.35 -35.06 71.37 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.55 -0.75 . . . . 1.07 112.084 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.536 HD13 ' HA ' ' A' ' 71' ' ' LEU . 14.7 mt -57.54 -47.02 83.14 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.326 -0.397 . . . . 1.73 110.961 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.649 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.1 OUTLIER -93.03 -7.75 44.86 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.142 -0.623 . . . . 2.47 111.808 -179.091 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -98.82 -18.0 18.17 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.221 -0.445 . . . . 2.68 111.013 -178.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.516 HG22 HD13 ' A' ' 80' ' ' ILE . 10.1 t -58.6 126.22 78.93 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.698 0.761 . . . . 1.46 110.973 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.2 Cg_exo -73.91 -25.75 13.93 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 123.31 2.674 . . . . 1.2 113.282 -171.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.0 t -101.35 -2.54 30.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.175 0.435 . . . . 1.84 112.175 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.516 HD13 HG22 ' A' ' 77' ' ' THR . 36.2 mt -119.29 136.87 55.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 121.931 -0.481 . . . . 1.93 110.911 -176.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -85.25 153.87 22.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.182 0.515 . . . . 2.06 110.578 -176.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.86 -30.35 71.45 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.306 -0.861 . . . . 2.89 112.942 -167.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.41 -36.88 79.74 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.94 -0.304 . . . . 2.06 111.437 -176.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -66.2 -36.08 82.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.61 0.719 . . . . 2.93 109.536 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 45.8 mm -74.97 -36.62 39.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.878 -1.056 . . . . 2.15 111.629 -177.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.524 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 23.0 ttmm -51.55 -39.22 57.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 2.96 111.49 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -71.41 -33.1 69.14 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.053 -0.521 . . . . 1.7 111.498 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . 0.441 ' HA ' ' CD ' ' A' ' 29' ' ' ARG . 57.7 mt -65.96 -67.7 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 112.569 0.581 . . . . 1.21 112.569 -170.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.749 ' H ' ' HD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -112.05 -27.56 8.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.466 0.543 . . . . 1.16 112.466 -170.596 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.524 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.7 t80 -67.35 -36.35 81.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.109 0.481 . . . . 1.66 111.233 -172.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.6 mt . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 1.23 110.279 177.39 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 121.677 0.751 . . . . 1.79 110.41 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 m -64.94 130.92 45.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.596 -0.729 . . . . 1.67 110.289 177.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.743 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.7 mt-30 -51.43 -47.05 63.13 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.905 0.705 . . . . 2.09 112.905 -167.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.61 -46.7 87.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.407 0.146 . . . . 2.17 110.956 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -58.72 -41.63 86.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.035 0.445 . . . . 3.07 109.962 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' VAL . . . . . 0.491 ' CG1' HD12 ' A' ' 15' ' ' ILE . 78.3 t -60.03 -57.74 10.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.499 -0.773 . . . . 0.39 110.772 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.13 -38.23 70.54 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.291 0.567 . . . . 1.1 111.276 -176.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -39.29 89.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.434 -0.803 . . . . 0.86 110.665 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -76.71 -38.31 54.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.119 -0.491 . . . . 2.05 112.038 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.491 HD12 ' CG1' ' A' ' 11' ' ' VAL . 2.2 mm -61.28 -47.34 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 C-N-CA 120.376 -0.529 . . . . 1.05 110.036 -177.448 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 p -58.25 -38.51 77.04 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.944 -0.571 . . . . 0.39 110.791 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -68.69 -45.16 72.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 0.7 110.835 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -67.01 -43.38 83.02 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.238 0.458 . . . . 3.55 112.238 -175.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.552 HD11 ' O ' ' A' ' 66' ' ' PRO . 3.6 mm? -79.41 -9.8 59.67 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.566 -0.454 . . . . 1.66 111.249 178.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 53.59 31.23 12.15 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.531 -0.914 . . . . 2.19 108.531 -170.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.593 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 19.6 tt0 -69.34 130.13 91.18 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 114.124 -1.398 . . . . 1.67 112.073 -169.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.444 ' HG2' ' H ' ' A' ' 23' ' ' LYS . 43.4 Cg_endo -64.41 -54.84 0.69 Allowed 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 124.352 3.368 . . . . 0.41 113.238 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.496 ' HZ1' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -85.61 67.89 10.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.918 0.866 . . . . 2.03 110.657 -176.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -62.9 -19.69 64.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.518 -1.219 . . . . 2.27 112.143 -172.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.39 -41.62 85.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.195 0.521 . . . . 2.14 110.119 174.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.746 HD22 ' HA ' ' A' ' 89' ' ' PHE . 1.6 tm? -73.1 -42.93 62.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.431 -0.804 . . . . 2.02 110.811 -176.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ILE . . . . . 0.593 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 5.1 tp -61.32 -32.17 52.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.916 0.388 . . . . 1.18 110.375 -177.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ALA . . . . . 0.568 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.25 -35.15 61.44 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.235 -0.439 . . . . 1.03 110.881 174.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.2 ttm-85 -62.31 -41.12 98.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.34 -0.391 . . . . 1.96 111.21 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 28.8 t -53.83 -45.25 62.3 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.192 0 CA-C-O 121.307 0.575 . . . . 1.15 109.595 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.568 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.5 t -53.21 -51.69 37.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 114.503 -1.226 . . . . 0.22 110.748 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -59.67 -42.64 93.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 4.21 111.709 -177.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 45.1 mm -74.99 -53.03 17.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 112.882 0.697 . . . . 1.5 112.882 -173.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ILE . . . . . 0.527 HD13 ' HB3' ' A' ' 38' ' ' LYS . 29.8 pt -95.71 -7.63 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 112.192 0.441 . . . . 1.12 112.192 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.07 161.91 26.56 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.345 -0.931 . . . . 0.28 112.392 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . 0.743 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 13.8 p-10 -63.84 -42.31 97.63 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 122.377 0.271 . . . . 0.99 111.601 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.416 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 39.5 ttpt -67.33 -50.42 60.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.051 -0.26 . . . . 3.52 111.019 -175.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' LYS . . . . . 0.527 ' HB3' HD13 ' A' ' 34' ' ' ILE . 12.2 mmmt -61.47 -26.43 67.88 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.66 0.244 . . . . 3.03 111.66 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.471 ' O ' HD21 ' A' ' 43' ' ' LEU . . . -67.36 -47.66 69.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.01 -0.367 . . . . 0.89 110.01 176.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ILE . . . . . 0.649 ' HA ' HD22 ' A' ' 43' ' ' LEU . 49.4 mm -66.35 -38.15 81.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 120.986 0.422 . . . . 1.78 110.219 177.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 32.9 mm-40 -55.9 -38.89 70.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.814 -0.63 . . . . 2.1 110.051 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.686 ' HB3' HD11 ' A' ' 73' ' ' LEU . 22.0 mt -62.88 -43.42 98.85 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.161 -0.472 . . . . 1.09 112.093 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.649 HD22 ' HA ' ' A' ' 40' ' ' ILE . 0.1 OUTLIER -64.19 -28.58 69.84 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 119.579 -0.849 . . . . 2.0 111.094 178.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.2 mtp -73.9 -36.89 64.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.142 0.496 . . . . 2.68 110.002 170.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . 0.489 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.3 mt-10 -65.77 -25.54 67.31 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.659 -0.7 . . . . 1.83 111.706 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' THR . . . . . 0.626 HG21 HD12 ' A' ' 73' ' ' LEU . 68.5 p -55.35 -40.0 70.72 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.868 0.366 . . . . 1.5 110.116 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.92 -32.86 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 1.4 110.859 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.45 ' HA ' ' HG3' ' A' ' 51' ' ' GLN . 29.1 mt-10 -71.41 -27.99 63.68 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.101 -0.5 . . . . 2.51 109.93 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 56.7 t -69.23 -43.25 81.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.118 0.485 . . . . 0.76 109.767 170.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' ' 46' ' ' THR . 4.6 mm-40 -55.83 -42.99 76.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.42 -0.809 . . . . 1.96 110.44 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.45 ' HG3' ' HA ' ' A' ' 48' ' ' GLU . 5.3 pp0? -82.55 -19.02 39.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.106 -0.497 . . . . 2.48 111.686 -176.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -87.87 -26.7 22.63 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.271 0.471 . . . . 2.4 112.271 -171.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.95 -12.54 2.37 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 119.967 -1.111 . . . . 1.65 113.29 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.33 -133.18 10.95 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.093 -1.051 . . . . 1.25 114.81 171.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.717 ' N ' ' HD3' ' A' ' 64' ' ' ARG . 0.6 OUTLIER -162.83 131.94 4.16 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.599 0.36 . . . . 2.02 110.895 -163.467 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PHE . . . . . 0.627 ' N ' HD21 ' A' ' 55' ' ' LEU . 34.6 t80 -116.74 110.55 18.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.269 -1.012 . . . . 3.65 108.269 168.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.576 ' CG2' HD13 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -77.73 -178.41 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.375 0.88 . . . . 1.28 113.375 -170.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.92 -46.53 60.84 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 115.801 -0.636 . . . . 1.44 111.345 -177.206 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.568 HD22 ' HB3' ' A' ' 61' ' ' SER . 0.9 OUTLIER -92.8 -36.74 12.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.081 -0.509 . . . . 2.28 110.212 176.423 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.22 -19.69 16.81 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 114.598 0.599 . . . . 1.21 114.598 169.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.568 ' HB3' HD22 ' A' ' 59' ' ' ASN . 8.4 t -66.7 -45.61 78.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 117.377 0.589 . . . . 2.35 110.412 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 62' ' ' ARG . 20.0 ttt180 -85.48 42.09 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.699 0.761 . . . . 3.36 109.687 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -46.95 132.04 11.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.477 -1.238 . . . . 4.14 113.076 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.717 ' HD3' ' N ' ' A' ' 55' ' ' LEU . 19.2 mmm180 68.42 57.97 0.44 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.754 -1.112 . . . . 2.6 112.238 175.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' THR . . . . . 0.762 HG21 ' HA2' ' A' ' 68' ' ' GLY . 5.3 t -82.73 144.69 49.02 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 114.779 -1.1 . . . . 1.26 108.19 169.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PRO . . . . . 0.552 ' O ' HD11 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.45 -60.35 0.9 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 123.825 3.017 . . . . 0.51 113.746 -173.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.687 ' O ' HD22 ' A' ' 71' ' ' LEU . . . -65.25 -37.22 93.74 Favored Glycine 0 C--O 1.224 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.29 111.163 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.762 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.37 -32.88 61.07 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.123 -0.539 . . . . 0.32 112.705 178.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 48.3 t -62.6 -40.69 89.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.226 0.536 . . . . 0.74 109.729 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . 0.545 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 12.5 t80 -65.24 -36.99 85.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.53 -0.759 . . . . 0.31 109.993 174.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.687 HD22 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -57.54 -43.53 84.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.177 -1.046 . . . . 1.14 108.177 177.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ASN . . . . . 0.553 ' HB2' HD22 ' A' ' 55' ' ' LEU . 60.4 t30 -55.93 -26.42 47.72 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.73 0.643 . . . . 1.14 110.924 -178.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.686 HD11 ' HB3' ' A' ' 42' ' ' LEU . 77.0 mt -56.39 -41.59 76.54 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.024 -0.535 . . . . 1.07 111.297 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.626 ' O ' HD12 ' A' ' 85' ' ' ILE . 6.5 mp -62.47 -19.02 63.12 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.014 0.435 . . . . 1.73 110.784 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LYS . . . . . 0.423 ' HZ1' ' HB2' ' A' ' 74' ' ' LEU . 1.1 mppt? -91.62 -23.37 19.88 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.729 0.27 . . . . 2.47 111.729 178.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -114.64 -11.99 12.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.675 0.274 . . . . 2.68 111.446 -173.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' THR . . . . . 0.745 HG22 HD13 ' A' ' 80' ' ' ILE . 5.5 t -60.24 132.75 90.35 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 121.661 0.743 . . . . 1.46 111.281 -172.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 3.4 Cg_exo -74.3 -36.97 2.8 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 123.536 2.824 . . . . 1.2 114.676 -167.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 39.6 m -111.88 17.59 19.62 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.135 1.161 . . . . 1.84 114.135 -168.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.745 HD13 HG22 ' A' ' 77' ' ' THR . 44.0 mt -115.2 134.03 59.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 118.289 0.495 . . . . 1.93 110.523 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 41.2 m -75.9 143.98 41.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.651 0.739 . . . . 2.06 111.562 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -52.58 -45.38 66.44 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.061 -1.427 . . . . 2.89 113.632 -168.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.82 -42.12 77.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.944 -0.302 . . . . 2.06 110.919 -177.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.32 -31.71 69.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.46 0.647 . . . . 2.93 110.001 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ILE . . . . . 0.626 HD12 ' O ' ' A' ' 74' ' ' LEU . 97.3 mt -66.86 -45.85 86.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.776 -1.102 . . . . 2.15 111.404 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.435 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 14.0 ttmm -56.27 -39.52 72.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.889 -0.596 . . . . 2.96 111.083 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -66.65 -31.69 72.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.562 -0.745 . . . . 1.7 112.622 -173.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.3 mt -69.87 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.359 0.503 . . . . 1.21 112.359 -173.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.746 ' HA ' HD22 ' A' ' 26' ' ' LEU . 9.9 p90 -95.59 -20.98 18.54 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.634 0.605 . . . . 1.16 112.634 -164.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' TYR . . . . . 0.435 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 90.7 t80 -93.77 -10.38 34.37 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.298 -0.41 . . . . 1.66 111.865 -165.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt . . . . . 0 C--N 1.325 -0.495 0 C-N-CA 120.686 -0.405 . . . . 1.23 111.768 -176.866 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 N-CA-C 111.907 -0.477 . . . . 9.67 111.907 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.67 -53.49 0.77 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.897 0.38 . . . . 8.13 110.963 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 48.2 tpp -111.56 -59.88 1.92 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.087 0.47 . . . . 7.59 110.551 -177.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -168.5 -22.07 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.609 -0.723 . . . . 4.97 109.701 -178.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 64.09 37.55 9.01 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 114.125 -1.398 . . . . 4.1 109.977 174.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.765 ' HB3' HD13 ' A' ' 40' ' ' ILE . 0.5 OUTLIER -74.58 62.7 1.05 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.21 -0.905 . . . . 1.79 112.571 -175.371 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 28.5 t -74.93 121.8 22.46 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.141 -1.059 . . . . 1.67 108.141 170.048 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.553 ' HB3' ' HB3' ' A' ' 36' ' ' ASN . 0.2 OUTLIER -56.64 -29.91 62.74 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.417 0.525 . . . . 2.09 112.417 -169.533 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.68 -47.96 70.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.907 0.384 . . . . 2.17 110.143 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -63.31 -40.49 97.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.887 -0.597 . . . . 3.07 110.25 175.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 93.1 t -57.44 -54.56 29.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 0.39 110.606 178.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -40.09 75.86 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.954 0.407 . . . . 1.1 111.576 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.71 -32.83 73.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.944 -0.571 . . . . 0.86 110.519 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -71.8 -48.15 48.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.739 -0.664 . . . . 2.05 111.013 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.602 HD11 HD22 ' A' ' 43' ' ' LEU . 1.2 mm -58.38 -50.89 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-O 121.277 0.561 . . . . 1.05 110.012 -178.18 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.527 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 12.7 p -59.08 -37.23 76.59 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.425 -0.807 . . . . 0.39 111.576 -175.092 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.71 -44.95 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.442 -0.344 . . . . 0.7 110.897 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.7 mtp85 -72.42 -29.47 63.74 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.507 0.558 . . . . 3.55 112.507 -173.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.616 ' HB3' ' HA3' ' A' ' 67' ' ' GLY . 3.8 mm? -93.97 0.04 55.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.758 0.313 . . . . 1.66 111.292 178.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 50.47 44.82 26.92 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 115.285 -0.871 . . . . 2.19 109.14 -173.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.841 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -61.26 120.15 52.37 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 114.523 -1.217 . . . . 1.67 112.427 -170.514 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.432 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 55.4 Cg_endo -64.46 -39.63 27.8 Favored 'Trans proline' 0 CA--C 1.529 0.273 0 C-N-CA 124.28 3.32 . . . . 0.41 113.084 174.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.525 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 35.2 pttt -120.45 63.8 0.84 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.195 0.522 . . . . 2.03 109.948 -172.063 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -56.25 -17.6 8.02 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.315 1.228 . . . . 2.27 114.315 -164.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.16 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 2.14 110.029 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.848 HD23 ' HA ' ' A' ' 89' ' ' PHE . 2.2 tm? -73.16 -51.57 17.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.573 -0.739 . . . . 2.02 110.387 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.841 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 7.3 tp -62.36 -32.29 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 116.231 -0.44 . . . . 1.18 111.03 -177.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.75 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -72.9 -33.0 65.74 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.56 0.695 . . . . 1.03 110.078 174.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.477 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 33.3 ttm180 -63.35 -40.92 98.61 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.23 -0.896 . . . . 1.96 111.908 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.657 ' HA ' HD12 ' A' ' 88' ' ' ILE . 33.0 t -53.19 -45.07 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 N-CA-C 108.781 -0.822 . . . . 1.15 108.781 177.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.75 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -53.02 -55.75 10.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.009 -1.45 . . . . 0.22 111.478 174.386 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -59.53 -40.14 86.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.608 -0.724 . . . . 4.21 111.304 -177.159 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 47.0 mm -75.3 -53.11 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.802 0.668 . . . . 1.5 112.802 -176.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.3 pt -88.06 -29.28 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 C-N-CA 120.061 -0.656 . . . . 1.12 112.248 -171.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.54 156.2 8.54 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.33 -0.938 . . . . 0.28 112.644 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.553 ' HB3' ' HB3' ' A' ' 8' ' ' GLN . 14.1 p-10 -62.25 -52.02 65.39 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.402 0.281 . . . . 0.99 111.568 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.495 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 84.8 tttt -71.74 -36.69 70.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 3.52 110.25 -179.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 11.1 mmmm -59.18 -29.76 67.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.701 -0.681 . . . . 3.03 111.269 -178.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.89 68.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.828 0.347 . . . . 0.89 110.676 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.765 HD13 ' HB3' ' A' ' 6' ' ' ASP . 37.1 mt -72.21 -34.19 48.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 120.911 0.386 . . . . 1.78 110.578 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.628 ' HA ' ' HE3' ' A' ' 44' ' ' MET . 16.4 mm-40 -55.29 -39.62 70.08 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.219 -0.66 . . . . 2.1 109.219 172.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.791 HD21 ' HB3' ' A' ' 73' ' ' LEU . 66.8 mt -67.4 -35.51 79.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.346 -0.843 . . . . 1.09 111.101 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.602 HD22 HD11 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -60.4 -37.23 80.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.906 0.384 . . . . 2.0 111.07 178.307 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.628 ' HE3' ' HA ' ' A' ' 41' ' ' GLU . 39.5 mtm -72.53 -36.49 68.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.265 0.555 . . . . 2.68 109.632 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -71.07 -28.36 64.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.538 -0.755 . . . . 1.83 111.317 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.867 HG22 HD12 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -61.0 -35.95 78.19 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 110.235 -0.283 . . . . 1.5 110.235 178.064 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.5 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -65.52 -35.07 79.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.048 0.452 . . . . 1.4 110.714 175.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.56 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 30.2 tt0 -68.31 -39.9 81.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.174 0.511 . . . . 2.51 109.657 178.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.4 t -69.11 -33.54 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.76 110.035 173.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.716 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 2.6 mm-40 -59.96 -44.06 94.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 1.96 111.233 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.56 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 17.7 pt20 -72.82 -19.73 61.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 2.48 111.245 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -100.09 -25.28 14.35 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.04 0.448 . . . . 2.4 111.766 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.21 41.67 25.81 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.963 -0.562 . . . . 1.65 113.228 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.87 128.99 9.41 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.55 -0.833 . . . . 1.25 113.922 -175.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 1.072 HD22 ' HB2' ' A' ' 72' ' ' ASN . 2.2 tm? -177.43 125.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.947 0.403 . . . . 2.02 110.43 170.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.524 ' N ' HD21 ' A' ' 55' ' ' LEU . 94.1 m-85 -124.26 108.69 12.51 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.498 -0.927 . . . . 3.65 108.498 165.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.736 HD13 ' HB2' ' A' ' 62' ' ' ARG . 0.6 OUTLIER -82.84 -176.57 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.193 -0.458 . . . . 1.28 111.438 -178.277 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.976 ' HE1' " H4'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -52.81 -36.32 58.25 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.999 0.741 . . . . 1.44 112.999 -173.416 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.588 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 0.1 OUTLIER -88.71 -35.52 16.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.606 0.595 . . . . 2.28 112.606 -179.069 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.87 -19.86 10.89 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 121.64 -0.314 . . . . 1.21 112.492 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.588 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 57.8 m -71.13 -58.41 3.58 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.971 0.415 . . . . 2.35 110.145 177.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.736 ' HB2' HD13 ' A' ' 57' ' ' ILE . 99.8 mtt180 -67.96 138.1 55.67 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.655 -1.239 . . . . 3.36 107.655 167.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -142.63 126.01 16.65 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.421 -0.585 . . . . 4.14 109.421 -172.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.718 ' H ' HD13 ' A' ' 55' ' ' LEU . 0.0 OUTLIER 62.51 56.07 2.12 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.476 -0.784 . . . . 2.6 112.194 -175.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.908 HG21 ' HA2' ' A' ' 68' ' ' GLY . 2.2 t -78.82 139.21 57.74 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 108.114 -1.069 . . . . 1.26 108.114 167.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.521 ' O ' HD13 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.32 -59.76 1.1 Allowed 'Trans proline' 0 N--CA 1.48 0.685 0 C-N-CA 123.459 2.773 . . . . 0.51 112.978 -173.178 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.708 ' O ' HD22 ' A' ' 71' ' ' LEU . . . -66.35 -38.86 94.0 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.407 -0.902 . . . . 0.29 111.245 177.3 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.908 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.68 -34.97 65.41 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.333 -0.433 . . . . 0.32 112.909 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.445 ' CG2' ' HD2' ' A' ' 64' ' ' ARG . 98.8 t -59.04 -42.78 87.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.106 0.479 . . . . 0.74 110.133 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.56 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 10.5 t80 -65.59 -37.01 85.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.825 -0.625 . . . . 0.31 109.975 174.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.708 HD22 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.39 -34.58 70.88 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.761 -0.829 . . . . 1.14 108.761 177.744 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 1.072 ' HB2' HD22 ' A' ' 55' ' ' LEU . 65.4 t30 -60.04 -30.61 69.3 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.656 -0.702 . . . . 1.14 110.186 177.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.867 HD12 HG22 ' A' ' 46' ' ' THR . 84.9 mt -58.62 -34.26 70.95 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.619 -0.719 . . . . 1.07 112.111 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.579 ' HB3' HD13 ' A' ' 85' ' ' ILE . 7.3 mp -65.73 -20.34 66.24 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.109 0.48 . . . . 1.73 110.795 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.691 ' HD3' ' C5 ' ' P' ' 600' ' ' ' A' . 8.9 mtmm -92.79 -34.35 13.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.281 0.562 . . . . 2.47 110.254 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -87.46 -13.11 44.1 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.154 -0.93 . . . . 2.68 110.877 -173.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.51 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 14.7 t -62.76 130.26 93.64 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.737 0.78 . . . . 1.46 110.751 -177.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.51 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 2.8 Cg_exo -74.86 -39.95 1.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.439 2.76 . . . . 1.2 113.725 -171.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.2 m -112.94 16.15 19.5 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.105 1.15 . . . . 1.84 114.105 -167.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 55.8 mt -112.6 137.69 44.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 118.683 0.674 . . . . 1.93 111.437 -177.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.4 m -74.04 141.44 45.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.523 -0.762 . . . . 2.06 111.042 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.15 -27.56 69.04 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.182 -0.917 . . . . 2.89 112.869 -174.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.84 -46.72 84.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 2.06 110.137 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 77.9 mm-40 -60.68 -38.86 86.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 2.93 109.869 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.579 HD13 ' HB3' ' A' ' 74' ' ' LEU . 33.4 mm -60.03 -50.65 79.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.377 -0.829 . . . . 2.15 110.608 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 18.8 ttpt -60.06 -43.46 95.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.608 -0.724 . . . . 2.96 110.284 176.022 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -63.72 -34.31 77.58 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.411 -0.813 . . . . 1.7 111.715 -174.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.657 HD12 ' HA ' ' A' ' 30' ' ' VAL . 72.9 mt -70.29 -72.34 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.174 0.435 . . . . 1.21 112.174 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.848 ' HA ' HD23 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -106.48 -16.38 14.55 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.361 0.874 . . . . 1.16 113.361 -168.589 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.663 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 86.9 t80 -77.47 -24.75 50.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.355 0.598 . . . . 1.66 110.212 -173.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt -82.65 -23.12 8.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.561 -0.745 . . . . 1.23 109.721 174.051 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 53.22 -93.65 0.03 OUTLIER 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.77 -1.105 . . . . 2.67 111.175 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -145.98 22.37 1.4 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.004 0.43 . . . . 4.89 110.27 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -61.09 139.38 58.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.566 -0.743 . . . . 3.67 110.777 -177.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.414 ' HE2' ' CE2' ' A' ' 97' ' ' TYR . 26.3 pttm -127.39 -175.8 3.55 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.366 -0.605 . . . . 8.45 109.366 177.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.58 120.18 26.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.426 0.632 . . . . 7.63 111.632 -174.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.414 ' CE2' ' HE2' ' A' ' 95' ' ' LYS . 34.6 m-85 -84.88 58.69 5.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.807 -0.633 . . . . 9.25 109.723 172.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 60.12 26.81 16.22 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.801 -0.636 . . . . 10.06 110.978 -177.282 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 66.31 -81.64 0.03 OUTLIER 'General case' 0 C--O 1.234 0.241 0 CA-C-N 114.967 -1.015 . . . . 12.32 112.188 176.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -115.08 -55.63 2.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.209 0.528 . . . . 14.08 110.701 -177.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.428 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . 35.4 ttpt -87.07 78.77 8.86 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.92 -0.582 . . . . 15.92 110.902 -175.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.64 93.9 6.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.807 -0.633 . . . . 17.13 109.992 175.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -75.09 91.17 2.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.167 0.508 . . . . 18.08 111.119 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.927 -1.035 . . . . 19.89 109.717 177.537 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' P' P ' 600' ' ' ' A' . . . . . 0.691 ' C5 ' ' HD3' ' A' ' 75' ' ' LYS . . . . . . . . 0 C3'--C2' 1.515 -0.933 0 C4'-C3'-C2' 99.678 -3.022 OUTLIER-DELTA 0.0 '__' . 2.98 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 601' ' ' ' U' . . . . . 0.976 " H4'" ' HE1' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.51 -1.36 1 C4'-C3'-C2' 96.369 -6.331 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 001 nuclear orig full ' P' P ' 602' ' ' ' C' . . . . . 0.653 ' OP1' ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 P-O3'-C3' 120.687 0.823 . 0.0 OUTLIER delta-1 7.67 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.882 0 C4'-C3'-C2' 103.809 1.109 . 0.049 1t . 7.9 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 112.023 -0.431 . . . . 9.67 112.023 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 56.58 43.58 25.42 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 122.942 0.497 . . . . 8.13 111.432 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 15.9 tpt -132.15 -64.07 0.79 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.461 -0.336 . . . . 7.59 110.829 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -162.42 52.89 0.21 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.988 0.423 . . . . 4.97 110.425 -176.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -71.55 -46.51 59.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.118 0.485 . . . . 4.1 110.044 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.721 ' HB2' HD21 ' A' ' 36' ' ' ASN . 3.6 m-20 -120.86 59.41 0.93 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.736 -0.665 . . . . 1.79 109.693 -178.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.2 m -58.33 124.34 19.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.66 -0.496 . . . . 1.67 109.66 176.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.434 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.9 mt-30 -57.21 -32.28 66.33 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.883 -0.599 . . . . 2.09 112.155 -169.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.92 -42.1 73.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.065 0.46 . . . . 2.17 110.291 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -71.03 -38.87 72.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.815 -0.63 . . . . 3.07 110.277 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.3 t -58.12 -51.53 69.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.39 110.981 178.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.95 -37.52 63.99 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.088 0.47 . . . . 1.1 111.155 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -68.69 -41.23 79.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.643 -0.708 . . . . 0.86 110.191 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 41.1 mm-40 -64.77 -47.41 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.572 -0.74 . . . . 2.05 111.907 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.648 HD12 HD13 ' A' ' 43' ' ' LEU . 3.4 mm -60.38 -49.87 82.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.887 0.375 . . . . 1.05 110.326 -175.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 23.1 p -61.16 -32.66 72.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.95 -0.568 . . . . 0.39 111.314 -176.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -70.54 -44.98 66.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.162 -0.472 . . . . 0.7 110.649 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 77.8 mtt180 -75.25 -31.36 60.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 3.55 111.693 -173.199 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.622 HD11 ' HA3' ' A' ' 67' ' ' GLY . 3.9 mm? -82.54 -15.56 51.86 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.623 -0.431 . . . . 1.66 111.173 174.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 55.18 29.91 13.54 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 108.395 -0.965 . . . . 2.19 108.395 -170.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.473 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 24.7 tt0 -71.73 132.96 84.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 113.904 -1.498 . . . . 1.67 112.271 -168.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.56 ' HD2' ' O4 ' ' P' ' 601' ' ' ' U' . 38.8 Cg_endo -63.47 -49.01 4.94 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 124.737 3.625 . . . . 0.41 113.625 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.602 ' HZ1' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -89.99 69.81 7.41 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.006 0.908 . . . . 2.03 110.708 -175.314 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.7 mttt -66.88 -23.82 66.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.175 . . . . 2.27 112.513 -170.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.37 -37.28 86.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.364 0.602 . . . . 2.14 110.021 175.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.602 HD11 ' HZ1' ' A' ' 23' ' ' LYS . 1.4 tm? -72.93 -40.98 64.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.348 -0.842 . . . . 2.02 110.479 -178.063 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.473 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 3.8 tp -63.09 -31.15 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 121.079 0.466 . . . . 1.18 109.919 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.661 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.48 -34.09 65.17 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.913 -0.585 . . . . 1.03 110.562 174.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -62.3 -41.38 98.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.211 -0.45 . . . . 1.96 110.923 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 19.9 t -54.02 -44.59 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 N-CA-C 109.001 -0.74 . . . . 1.15 109.001 177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.661 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 91.8 t -53.2 -49.04 53.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 114.34 -1.3 . . . . 0.22 111.038 175.389 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 49.4 mtt180 -60.55 -47.48 86.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.586 -0.734 . . . . 4.21 110.862 -178.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 41.7 mm -73.94 -52.24 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.701 -0.681 . . . . 1.5 112.329 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 21.4 pt -84.94 -28.86 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.628 -0.429 . . . . 1.12 111.944 -172.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.21 155.98 9.94 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.4 -0.905 . . . . 0.28 112.263 -179.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.721 HD21 ' HB2' ' A' ' 6' ' ' ASP . 5.3 p-10 -59.51 -49.42 77.84 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.778 0.288 . . . . 0.99 111.778 -175.83 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -71.62 -33.67 69.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.811 0.339 . . . . 3.52 111.05 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.26 -31.68 72.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.038 -0.528 . . . . 3.03 110.832 -178.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.477 ' O ' ' HG ' ' A' ' 43' ' ' LEU . . . -64.15 -44.73 91.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.28 -0.418 . . . . 0.89 110.454 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.05 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.124 -0.489 . . . . 1.78 110.317 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.444 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 51.4 mt-10 -58.41 -42.95 88.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.127 -0.488 . . . . 2.1 110.822 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.844 ' HB3' HD11 ' A' ' 73' ' ' LEU . 53.1 mt -63.27 -37.87 88.95 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.512 -0.313 . . . . 1.09 110.847 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.648 HD13 HD12 ' A' ' 15' ' ' ILE . 85.6 mt -60.99 -30.78 70.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.073 0.463 . . . . 2.0 111.123 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.2 tmm? -73.99 -39.17 63.85 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.352 -0.611 . . . . 2.68 109.352 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 31.0 mt-10 -70.45 -25.49 63.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.658 -0.701 . . . . 1.83 112.464 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.642 HG21 HD12 ' A' ' 73' ' ' LEU . 71.2 p -52.04 -41.5 62.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.921 0.391 . . . . 1.5 110.717 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.56 -35.07 75.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.684 -0.689 . . . . 1.4 111.418 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -68.85 -33.93 74.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.984 0.421 . . . . 2.51 110.498 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 81.5 t -76.96 -35.81 24.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.967 0.413 . . . . 0.76 110.323 174.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.555 ' HA ' HH21 ' A' ' 64' ' ' ARG . 6.7 mm-40 -61.05 -43.56 98.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.042 -0.526 . . . . 1.96 111.361 177.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -69.81 -26.27 64.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.813 0.339 . . . . 2.48 110.782 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -83.17 -25.07 32.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 2.4 111.04 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.49 ' HA3' ' NH1' ' A' ' 64' ' ' ARG . . . 72.95 44.4 37.09 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.521 -0.763 . . . . 1.65 111.804 -178.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.43 126.01 7.09 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.248 -0.977 . . . . 1.25 114.865 -170.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.72 HD12 ' HB2' ' A' ' 72' ' ' ASN . 38.6 tp -176.87 127.72 0.17 Allowed 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.23 0.538 . . . . 2.02 111.72 163.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -119.27 112.69 19.79 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 107.971 -1.122 . . . . 3.65 107.971 163.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.753 HD11 " O2'" ' P' ' 601' ' ' ' U' . 1.1 pt -86.96 -165.36 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.805 -0.634 . . . . 1.28 111.516 -175.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.982 ' HE1' " H4'" ' P' ' 601' ' ' ' U' . 3.9 mtt -42.12 -46.33 4.28 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.876 0.735 . . . . 1.44 111.806 -173.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -120.82 -33.27 3.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.101 -0.499 . . . . 2.28 111.193 -174.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.46 ' O ' ' HB3' ' A' ' 63' ' ' ARG . . . 106.16 -12.07 44.41 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.285 -0.96 . . . . 1.21 115.257 172.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.4 ' C ' ' H ' ' A' ' 63' ' ' ARG . 65.8 p -65.28 -55.88 15.85 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 118.46 1.13 . . . . 2.35 111.17 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.471 ' O ' HD12 ' A' ' 57' ' ' ILE . 60.4 mtp180 -81.71 26.9 0.47 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.528 -0.76 . . . . 3.36 110.368 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.46 ' HB3' ' O ' ' A' ' 60' ' ' GLY . 25.8 ptt180 -46.53 133.39 10.15 Favored 'General case' 0 C--O 1.233 0.21 0 O-C-N 123.916 0.76 . . . . 4.14 112.434 -169.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.685 ' HA ' HD21 ' A' ' 55' ' ' LEU . 4.8 tpt180 73.14 80.67 0.13 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.002 -0.999 . . . . 2.6 111.817 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.883 HG22 ' HA2' ' A' ' 68' ' ' GLY . 0.3 OUTLIER -105.36 147.72 35.08 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.885 -1.052 . . . . 1.26 108.279 172.127 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.476 ' O ' HD11 ' A' ' 19' ' ' LEU . 9.9 Cg_endo -45.76 -59.69 1.1 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 123.536 2.824 . . . . 0.51 112.998 -176.033 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.689 ' HA2' ' O4 ' ' P' ' 601' ' ' ' U' . . . -63.31 -40.74 99.31 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.085 -1.055 . . . . 0.29 110.85 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.883 ' HA2' HG22 ' A' ' 65' ' ' THR . . . -56.46 -29.56 57.43 Favored Glycine 0 CA--C 1.52 0.379 0 CA-C-N 115.139 -0.53 . . . . 0.32 113.289 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.47 ' CG2' ' HD2' ' A' ' 64' ' ' ARG . 41.5 t -67.75 -33.59 62.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.118 0.485 . . . . 0.74 109.997 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.604 ' HB2' HD13 ' A' ' 19' ' ' LEU . 12.1 t80 -65.23 -35.74 81.98 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.305 -0.628 . . . . 0.31 109.305 171.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.74 HD13 " O5'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -58.22 -36.26 72.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.462 -0.94 . . . . 1.14 108.462 178.532 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.72 ' HB2' HD12 ' A' ' 55' ' ' LEU . 44.0 t-20 -56.58 -35.21 67.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.651 -0.704 . . . . 1.14 109.9 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.844 HD11 ' HB3' ' A' ' 42' ' ' LEU . 95.6 mt -58.13 -37.01 73.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.153 -0.931 . . . . 1.07 112.178 -176.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.465 ' HB3' ' CG2' ' A' ' 85' ' ' ILE . 6.4 mp -65.83 -28.87 69.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.162 0.506 . . . . 1.73 110.479 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.545 ' HD2' ' C2 ' ' P' ' 600' ' ' ' A' . 0.0 OUTLIER -80.92 -42.5 21.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.121 0.486 . . . . 2.47 110.648 176.715 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -100.28 26.12 6.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.728 -0.669 . . . . 2.68 111.363 -173.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.488 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 5.4 t -80.95 124.73 81.19 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 121.447 0.642 . . . . 1.46 110.517 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.488 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.4 Cg_exo -75.78 -9.97 19.83 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.29 2.66 . . . . 1.2 113.01 -176.62 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.5 m -111.51 -20.71 12.1 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.208 0.818 . . . . 1.84 113.208 -170.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.434 ' HB ' HG22 ' A' ' 77' ' ' THR . 17.7 mt -111.4 139.87 33.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.774 0.321 . . . . 1.93 111.313 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.8 t -76.17 142.0 41.69 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.31 0.576 . . . . 2.06 110.044 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.403 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 1.8 mp0 -57.23 -37.59 72.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.691 -1.141 . . . . 2.89 113.116 -168.848 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.54 -37.28 85.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 2.06 110.764 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -68.37 -23.64 64.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.587 0.708 . . . . 2.93 110.073 -177.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.465 ' CG2' ' HB3' ' A' ' 74' ' ' LEU . 46.5 mm -70.73 -36.96 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.839 -1.073 . . . . 2.15 111.169 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.541 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 37.4 ttmt -56.83 -36.15 69.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.485 -0.78 . . . . 2.96 111.896 -177.249 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.52 -33.29 69.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 1.7 111.629 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.7 mt -70.95 -72.21 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 113.167 0.803 . . . . 1.21 113.167 -170.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.733 ' HD1' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -104.3 -19.19 14.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.695 0.628 . . . . 1.16 112.695 -166.854 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.541 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 60.5 t80 -74.83 -23.86 58.52 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.311 0.577 . . . . 1.66 110.945 -173.724 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 47.1 mt -88.99 -8.12 10.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.605 -0.725 . . . . 1.23 111.022 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 55.47 -95.31 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.399 0.618 . . . . 2.67 111.677 -176.665 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -139.46 16.54 2.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.484 -0.78 . . . . 4.89 109.817 -178.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -73.9 75.0 1.65 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.499 0.666 . . . . 3.67 111.266 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 43.6 pttt -128.04 116.19 19.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.318 -0.856 . . . . 8.45 108.81 173.119 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -98.73 -48.58 4.9 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.079 -0.51 . . . . 7.63 111.312 -172.56 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -98.11 62.84 1.56 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.082 0.468 . . . . 9.25 112.241 -170.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -108.47 125.35 51.69 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.98 -1.119 . . . . 10.06 107.98 164.464 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -78.06 80.17 4.5 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.939 0.4 . . . . 12.32 111.683 -173.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.645 ' HZ2' ' HB2' ' A' ' 100' ' ' LYS . 0.2 OUTLIER -83.12 55.09 2.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 122.026 0.917 . . . . 14.08 108.742 172.84 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 56.2 pttt -158.71 144.41 16.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.725 -1.125 . . . . 15.92 108.832 -177.39 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 59.65 29.58 19.15 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.289 0.566 . . . . 17.13 110.284 -173.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -157.36 -165.18 1.74 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.302 -0.863 . . . . 18.08 109.811 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.991 -0.528 . . . . 19.89 110.934 -179.982 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' P' P ' 600' ' ' ' A' . . . . . 0.711 " H5'" HD13 ' A' ' 55' ' ' LEU . . . . . . . . 0 C3'--C2' 1.514 -0.99 0 C3'-C2'-C1' 98.232 -3.631 OUTLIER-DELTA 0.0 '__' . 2.98 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 601' ' ' ' U' . . . . . 0.982 " H4'" ' HE1' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.51 -1.385 1 C4'-C3'-C2' 96.042 -6.658 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' P' P ' 602' ' ' ' C' . . . . . 0.545 ' OP1' ' HB ' ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.424 -0.986 0 C4'-C3'-C2' 104.67 1.97 . 0.0 OUTLIER delta-1 7.67 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.933 0 C4'-C3'-C2' 105.726 3.026 . 0.0 OUTLIER gamma 7.9 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 N-CA-C 111.555 -0.618 . . . . 9.67 111.555 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.94 -49.58 5.97 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.487 0.184 . . . . 8.13 111.198 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -159.59 164.22 34.39 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.105 0.479 . . . . 7.59 110.85 -175.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -130.15 103.51 6.77 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.638 -0.71 . . . . 4.97 109.877 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -84.54 85.5 7.41 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.458 0.647 . . . . 4.1 109.568 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.525 ' HB2' ' CG2' ' A' ' 11' ' ' VAL . 12.0 p-10 -75.99 105.59 7.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.008 -0.996 . . . . 1.79 111.67 -172.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.5 m -79.86 127.87 32.75 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.443 -0.799 . . . . 1.67 109.363 175.279 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.714 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 3.4 pt20 -51.91 -43.65 63.49 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.731 1.011 . . . . 2.09 113.731 -167.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -71.36 -34.95 70.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.115 0.483 . . . . 2.17 110.268 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -65.67 -42.19 91.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 3.07 109.666 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.525 ' CG2' ' HB2' ' A' ' 6' ' ' ASP . 60.2 t -62.15 -42.85 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.602 -0.726 . . . . 0.39 110.431 176.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.73 -41.7 77.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 1.1 111.36 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.27 -31.11 71.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.318 -0.401 . . . . 0.86 110.418 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.64 -50.54 64.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.463 -0.335 . . . . 2.05 110.779 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.467 HD12 HD13 ' A' ' 43' ' ' LEU . 2.0 mm -60.57 -49.48 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.768 0.318 . . . . 1.05 110.555 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.503 ' HB2' ' HD2' ' A' ' 24' ' ' LYS . 18.9 p -57.96 -43.04 86.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.864 -0.607 . . . . 0.39 111.454 -176.052 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.72 -41.52 98.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.666 -0.697 . . . . 0.7 111.141 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -77.42 -36.91 52.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 3.55 111.905 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.864 HD13 ' HA3' ' A' ' 67' ' ' GLY . 4.5 mm? -83.04 -5.61 59.17 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.973 0.36 . . . . 1.66 111.973 -178.167 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 55.82 39.97 30.68 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.762 -0.829 . . . . 2.19 108.762 -172.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.797 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.12 120.34 63.5 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.31 -1.313 . . . . 1.67 111.753 -171.065 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.08 -34.96 12.55 Favored 'Trans proline' 0 N--CA 1.474 0.351 0 C-N-CA 123.976 3.117 . . . . 0.41 113.478 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.658 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 35.5 pttt -120.38 66.24 0.83 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.319 0.58 . . . . 2.03 109.499 -173.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.503 ' HD2' ' HB2' ' A' ' 16' ' ' SER . 40.1 mtmt -61.06 -12.41 11.78 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.035 1.124 . . . . 2.27 114.035 -163.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -69.23 -28.66 66.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.339 -0.544 . . . . 2.14 109.581 173.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.849 HD23 ' HA ' ' A' ' 89' ' ' PHE . 1.8 tm? -71.84 -52.05 19.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.46 -0.791 . . . . 2.02 109.926 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.797 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 10.1 tp -62.22 -34.58 64.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 1.18 110.525 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.718 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -70.88 -32.24 69.16 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.548 0.69 . . . . 1.03 110.477 174.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -66.91 -41.6 86.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.548 -0.751 . . . . 1.96 111.587 -179.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . 0.491 ' HA ' HD11 ' A' ' 88' ' ' ILE . 16.3 t -53.4 -44.72 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 108.66 -0.867 . . . . 1.15 108.66 176.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.718 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.1 t -52.51 -53.42 20.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 113.63 -1.623 . . . . 0.22 111.201 175.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -66.24 -35.51 80.6 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.56 -0.745 . . . . 4.21 112.06 -174.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 50.5 mm -75.03 -51.82 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.294 0.479 . . . . 1.5 112.294 -177.15 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.7 pt -90.18 -25.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.89 0.376 . . . . 1.12 111.854 -175.126 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.1 139.56 6.24 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.722 -0.751 . . . . 0.28 111.356 -175.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.714 ' HB3' ' HA ' ' A' ' 8' ' ' GLN . 0.9 OUTLIER -55.55 -37.95 68.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.834 0.349 . . . . 0.99 111.86 -179.195 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -71.58 -33.87 69.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.145 0.498 . . . . 3.52 110.262 -178.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -69.86 -31.12 68.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.934 -0.576 . . . . 3.03 110.714 176.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.79 -38.66 91.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.13 0.49 . . . . 0.89 110.222 175.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.26 -41.65 93.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 115.912 -0.585 . . . . 1.78 110.441 176.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -55.73 -47.0 77.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.779 -0.646 . . . . 2.1 110.448 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.754 ' HB3' HD11 ' A' ' 73' ' ' LEU . 48.5 mt -60.58 -38.62 85.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.619 -0.719 . . . . 1.09 111.26 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.467 HD13 HD12 ' A' ' 15' ' ' ILE . 14.4 mt -60.05 -32.48 70.96 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.877 0.37 . . . . 2.0 111.498 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.8 mtp -74.59 -37.01 63.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.111 0.481 . . . . 2.68 109.881 175.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 52.3 mt-10 -70.55 -27.45 64.15 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.444 -0.798 . . . . 1.83 111.623 179.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.526 HG22 HD12 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -62.87 -39.12 93.46 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.767 0.317 . . . . 1.5 110.833 -177.878 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.59 -44.15 89.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.53 . . . . 1.4 111.785 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.925 ' HA ' ' HG2' ' A' ' 51' ' ' GLN . 6.6 pt-20 -75.69 -30.27 59.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.671 -0.412 . . . . 2.51 111.422 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 84.5 t -65.23 -35.62 75.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.496 0.665 . . . . 0.76 109.421 173.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -69.29 -47.02 65.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.553 -0.748 . . . . 1.96 111.121 175.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.925 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 17.0 pt20 -65.12 -27.04 68.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 2.48 110.728 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -94.27 -4.19 49.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.047 -0.524 . . . . 2.4 111.454 -177.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.23 50.08 41.76 Favored Glycine 0 C--N 1.331 0.28 0 CA-C-N 115.919 -0.582 . . . . 1.65 113.386 176.302 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -108.93 111.96 3.37 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.231 -0.985 . . . . 1.25 113.975 -177.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.66 HD12 ' HB2' ' A' ' 72' ' ' ASN . 34.6 tp -177.34 126.95 0.15 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.576 0.584 . . . . 2.02 112.576 167.178 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -125.65 93.54 3.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.592 -0.731 . . . . 3.65 109.081 164.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.783 ' HA ' " O4'" ' P' ' 600' ' ' ' A' . 3.8 pt -72.15 -170.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 112.451 0.537 . . . . 1.28 112.451 -176.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.977 ' HE1' " H4'" ' P' ' 601' ' ' ' U' . 2.7 mtt -42.01 -47.63 4.46 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.88 0.738 . . . . 1.44 111.468 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.505 ' ND2' H5'' ' P' ' 602' ' ' ' C' . 6.1 p30 -103.89 -35.81 8.02 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.797 -0.638 . . . . 2.28 111.746 -172.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 97.13 -19.52 54.47 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.069 -0.586 . . . . 1.21 113.701 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.481 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 66.1 m -72.61 -45.5 58.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.183 0.492 . . . . 2.35 111.251 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.688 ' HB3' HD13 ' A' ' 57' ' ' ILE . 7.4 ttm180 -80.47 49.37 1.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.91 0.862 . . . . 3.36 109.091 176.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.4 123.17 12.15 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.651 -1.159 . . . . 4.14 111.543 -173.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.426 ' HG2' ' HB3' ' A' ' 55' ' ' LEU . 1.2 mmm180 72.27 56.81 0.15 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 113.452 0.908 . . . . 2.6 113.452 173.121 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.73 HG21 ' HA2' ' A' ' 68' ' ' GLY . 3.9 t -77.74 140.65 63.51 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.657 -0.701 . . . . 1.26 109.159 169.228 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -48.18 -59.45 1.24 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 C-N-CA 124.047 3.165 . . . . 0.51 113.43 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.864 ' HA3' HD13 ' A' ' 19' ' ' LEU . . . -62.26 -39.86 98.26 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.868 -0.893 . . . . 0.29 110.868 177.22 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.73 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -58.94 -31.67 68.85 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.109 -0.546 . . . . 0.32 113.247 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 43.2 t -62.76 -36.39 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.181 0.515 . . . . 0.74 110.239 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.563 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 13.4 t80 -65.48 -36.37 83.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.955 -0.566 . . . . 0.31 109.634 173.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.726 HD13 " O5'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -59.4 -34.64 72.7 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.605 -0.887 . . . . 1.14 108.605 178.387 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.66 ' HB2' HD12 ' A' ' 55' ' ' LEU . 62.1 t30 -61.27 -30.41 70.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.266 -0.879 . . . . 1.14 110.489 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.754 HD11 ' HB3' ' A' ' 42' ' ' LEU . 71.1 mt -57.99 -36.09 72.14 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.296 -0.865 . . . . 1.07 111.885 -177.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.522 ' HB3' HD13 ' A' ' 85' ' ' ILE . 8.2 mp -60.83 -21.9 63.64 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.105 0.478 . . . . 1.73 110.859 -178.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.494 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -93.05 -38.45 11.62 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.989 -0.445 . . . . 2.47 111.576 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.609 ' OD1' ' HA ' ' A' ' 73' ' ' LEU . 2.9 p-10 -93.37 -8.14 42.73 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.914 -0.315 . . . . 2.68 111.648 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.553 HG22 ' HB ' ' A' ' 80' ' ' ILE . 7.9 t -56.22 127.65 70.98 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.436 0.636 . . . . 1.46 111.333 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.439 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.3 Cg_exo -76.07 -14.82 18.76 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.551 2.834 . . . . 1.2 113.055 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.6 m -112.31 -17.27 12.78 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.451 0.908 . . . . 1.84 113.451 -169.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.553 ' HB ' HG22 ' A' ' 77' ' ' THR . 36.5 mt -103.84 139.98 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.03 0.443 . . . . 1.93 112.096 -169.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 46.9 m -84.33 156.57 21.84 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.805 -0.634 . . . . 2.06 111.678 -179.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.458 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 34.3 tt0 -65.92 -41.31 91.55 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.248 1.203 . . . . 2.89 114.248 -164.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.86 -47.03 85.13 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.55 -0.46 . . . . 2.06 111.63 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -56.83 -33.56 66.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 2.93 110.528 179.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.522 HD13 ' HB3' ' A' ' 74' ' ' LEU . 36.3 mm -60.12 -50.74 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.796 -0.638 . . . . 2.15 110.652 177.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.514 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.8 ttpt -59.25 -39.1 81.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 2.96 110.753 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -65.84 -33.07 74.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.437 -0.347 . . . . 1.7 111.652 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.491 HD11 ' HA ' ' A' ' 30' ' ' VAL . 75.2 mt -70.44 -71.44 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.457 0.54 . . . . 1.21 112.457 -174.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.849 ' HA ' HD23 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -104.8 -10.78 17.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.32 0.859 . . . . 1.16 113.32 -165.836 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.514 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.9 t80 -89.46 -22.51 22.46 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.167 0.508 . . . . 1.66 110.947 -173.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.5 mt -88.78 -29.04 5.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.092 -0.504 . . . . 1.23 110.852 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 60.58 -83.61 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.501 -0.772 . . . . 2.67 111.124 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.47 ' N ' HD21 ' A' ' 93' ' ' ASN . 0.1 OUTLIER -161.28 20.1 0.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.968 0.413 . . . . 4.89 110.331 178.752 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -84.65 59.59 5.6 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.144 0.497 . . . . 3.67 111.358 -175.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -146.35 127.21 14.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.813 -0.63 . . . . 8.45 110.463 177.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 72.72 -67.35 0.27 Allowed 'General case' 0 N--CA 1.465 0.31 0 O-C-N 123.918 0.761 . . . . 7.63 112.785 171.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -96.76 81.7 3.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.439 0.638 . . . . 9.25 111.865 -170.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.21 172.14 7.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.207 -0.906 . . . . 10.06 109.626 174.469 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -119.23 68.76 0.81 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.874 0.368 . . . . 12.32 110.947 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.479 ' NZ ' ' HB2' ' A' ' 100' ' ' LYS . 4.7 ttmp? -108.85 90.12 3.2 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.906 0.384 . . . . 14.08 110.296 176.17 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -82.23 -19.47 39.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.019 0.438 . . . . 15.92 110.733 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -83.24 6.29 20.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.072 -0.513 . . . . 17.13 111.048 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -74.2 87.56 1.95 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.095 -0.502 . . . . 18.08 110.703 178.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 . . . . . 0 C--O 1.246 0.921 0 CA-C-O 118.259 -0.877 . . . . 19.89 109.614 177.192 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' P' P ' 600' ' ' ' A' . . . . . 0.783 " O4'" ' HA ' ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.515 -0.909 0 C3'-C2'-C1' 99.057 -2.714 OUTLIER-DELTA 0.0 '__' . 2.98 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 601' ' ' ' U' . . . . . 0.977 " H4'" ' HE1' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.51 -1.359 1 C4'-C3'-C2' 96.136 -6.564 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' P' P ' 602' ' ' ' C' . . . . . 0.505 H5'' ' ND2' ' A' ' 59' ' ' ASN . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 P-O3'-C3' 122.356 2.214 . 0.0 OUTLIER delta-1 7.67 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 C3'-C2'-C1' 99.994 -1.673 . 0.0 OUTLIER . 7.9 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.785 -0.526 . . . . 9.67 111.785 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.27 77.13 1.93 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.836 0.35 . . . . 8.13 110.778 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 48.8 ttm -107.58 -52.63 2.74 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.841 0.353 . . . . 7.59 110.824 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.33 32.81 4.81 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.244 -0.435 . . . . 4.97 111.074 -177.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -95.8 165.16 12.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.381 -0.372 . . . . 4.1 110.21 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -109.31 68.59 0.68 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.188 0.518 . . . . 1.79 109.944 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -56.03 131.84 48.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.463 -0.79 . . . . 1.67 109.427 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.54 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 96.7 mt-30 -58.44 -33.31 69.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.031 -0.531 . . . . 2.09 112.249 -173.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.15 -40.23 86.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.133 0.492 . . . . 2.17 110.42 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.561 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 62.5 tttm -70.24 -42.37 72.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.759 -0.655 . . . . 3.07 110.262 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 91.1 t -59.26 -42.61 87.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.39 110.598 177.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.68 -41.42 73.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.038 0.447 . . . . 1.1 110.57 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -67.35 -42.12 84.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 0.86 110.426 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.561 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 71.6 mm-40 -56.86 -51.03 70.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.108 -0.496 . . . . 2.05 110.74 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.467 ' O ' HD21 ' A' ' 19' ' ' LEU . 4.6 mm -63.47 -51.8 66.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 120.709 -0.396 . . . . 1.05 110.318 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.651 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 31.4 p -64.03 -41.59 97.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.445 -0.343 . . . . 0.39 111.759 -172.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -62.54 -44.62 95.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.066 0.46 . . . . 0.7 110.646 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.2 mtt180 -78.73 -31.16 46.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.202 -0.454 . . . . 3.55 111.833 -175.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 1.093 HD11 ' HA3' ' A' ' 67' ' ' GLY . 4.3 mm? -77.56 -15.73 59.08 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 111.926 0.343 . . . . 1.66 111.926 177.458 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 57.15 41.22 27.48 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 107.65 -1.241 . . . . 2.19 107.65 -166.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.671 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 7.2 tp10 -81.18 115.7 57.95 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 113.243 -1.799 . . . . 1.67 110.968 -170.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.427 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 42.2 Cg_endo -61.98 -47.88 9.66 Favored 'Trans proline' 0 N--CA 1.477 0.535 0 C-N-CA 124.416 3.411 . . . . 0.41 113.521 177.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.726 ' HZ3' HD12 ' A' ' 71' ' ' LEU . 45.1 pttt -92.59 72.52 5.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.058 0.932 . . . . 2.03 109.649 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.431 ' HA ' ' CG2' ' A' ' 27' ' ' ILE . 65.5 mttt -65.23 -17.66 64.67 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.428 -1.26 . . . . 2.27 111.441 -173.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.34 -39.06 59.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.418 -0.355 . . . . 2.14 110.524 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.579 ' HG ' ' OE2' ' A' ' 92' ' ' GLU . 1.8 tm? -73.43 -43.61 60.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.003 0.43 . . . . 2.02 109.966 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.671 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 10.6 tp -64.08 -26.92 41.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.969 -0.56 . . . . 1.18 109.756 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.693 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.22 -33.31 65.27 Favored 'General case' 0 CA--C 1.523 -0.073 0 CA-C-N 116.267 -0.424 . . . . 1.03 110.934 172.288 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.448 ' HD3' ' HA ' ' A' ' 88' ' ' ILE . 6.3 ttm180 -59.35 -45.74 90.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.718 0.266 . . . . 1.96 111.718 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 9.5 p -57.55 -36.71 54.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.594 -0.521 . . . . 1.15 109.594 -179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.693 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 76.8 t -54.87 -50.51 61.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.112 -0.949 . . . . 0.22 110.779 173.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -63.49 -43.19 97.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.398 -0.819 . . . . 4.21 111.41 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 17.2 mt -74.96 -51.89 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.02 0.748 . . . . 1.5 113.02 -172.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.521 HD11 ' HB3' ' A' ' 38' ' ' LYS . 34.1 pt -88.34 -28.2 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 120.274 -0.57 . . . . 1.12 111.661 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 153.86 8.66 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.363 -0.922 . . . . 0.28 112.492 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.54 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 24.7 p-10 -61.44 -40.25 93.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.672 0.272 . . . . 0.99 111.112 -179.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 87.2 tttt -72.06 -41.68 67.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.364 -0.38 . . . . 3.52 110.657 -178.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.521 ' HB3' HD11 ' A' ' 34' ' ' ILE . 13.8 mmmt -64.67 -27.72 69.12 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.114 -0.234 . . . . 3.03 111.365 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.34 -40.2 85.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.053 0.454 . . . . 0.89 109.904 174.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 45.3 mm -70.08 -40.13 78.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.89 -0.595 . . . . 1.78 110.079 176.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 15.5 mm-40 -58.65 -43.25 89.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.841 -0.618 . . . . 2.1 110.395 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.722 HD21 ' HB3' ' A' ' 73' ' ' LEU . 34.8 mt -59.98 -33.76 72.39 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.254 -0.43 . . . . 1.09 110.846 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.434 HD12 HD11 ' A' ' 15' ' ' ILE . 63.1 mt -62.91 -32.42 73.7 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.879 -0.328 . . . . 2.0 110.553 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.7 mmm -76.97 -39.64 49.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.935 0.398 . . . . 2.68 110.072 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.553 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.8 mt-10 -60.5 -27.18 67.39 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.699 -0.682 . . . . 1.83 111.501 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.55 HG21 ' O ' ' A' ' 42' ' ' LEU . 72.4 p -56.86 -37.48 71.38 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-O 120.607 0.241 . . . . 1.5 110.806 177.727 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.67 -37.58 82.06 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.057 -0.52 . . . . 1.4 111.754 -173.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.57 -37.2 82.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.939 0.399 . . . . 2.51 110.03 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -76.28 -32.65 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.023 0.44 . . . . 0.76 110.194 176.169 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.97 ' HA ' HH22 ' A' ' 64' ' ' ARG . 33.3 mm-40 -59.64 -48.56 81.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 1.96 111.541 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -69.89 -21.52 63.31 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.984 0.365 . . . . 2.48 111.984 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -96.99 -25.84 15.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.964 0.411 . . . . 2.4 112.001 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.27 45.62 14.52 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 116.011 -0.54 . . . . 1.65 113.506 176.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -102.29 129.01 9.74 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.488 -0.863 . . . . 1.25 114.5 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.919 HD11 ' HB2' ' A' ' 72' ' ' ASN . 58.9 tp -176.58 127.77 0.19 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.229 0.538 . . . . 2.02 112.16 165.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -121.33 108.88 14.23 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.563 -1.273 . . . . 3.65 107.563 162.249 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.659 HD11 " O2'" ' P' ' 601' ' ' ' U' . 0.9 OUTLIER -80.89 -174.93 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.426 -0.352 . . . . 1.28 111.904 -174.102 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.975 ' HE1' " H4'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -55.82 -33.46 64.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.68 0.622 . . . . 1.44 112.68 -173.156 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -89.65 -36.46 15.24 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.179 -0.608 . . . . 2.28 112.166 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.85 -15.34 32.36 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.734 -0.547 . . . . 1.21 111.734 -175.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.0 m -72.58 -59.85 2.52 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.32 0.581 . . . . 2.35 110.961 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -85.09 145.69 27.52 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 106.255 -1.757 . . . . 3.36 106.255 167.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -132.27 130.97 41.59 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 119.358 -0.937 . . . . 4.14 110.645 -177.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.97 HH22 ' HA ' ' A' ' 50' ' ' GLU . 9.2 tpt180 69.95 88.13 0.11 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.932 0.872 . . . . 2.6 112.359 172.686 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.783 HG21 ' HA2' ' A' ' 68' ' ' GLY . 1.3 t -110.37 147.49 36.46 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.83 -1.077 . . . . 1.26 109.072 172.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -45.25 -58.85 1.38 Allowed 'Trans proline' 0 N--CA 1.486 1.077 0 C-N-CA 123.939 3.093 . . . . 0.51 113.29 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 1.093 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -63.46 -42.29 99.04 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 110.545 -1.022 . . . . 0.29 110.545 176.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.783 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.56 -28.93 56.91 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.667 -0.767 . . . . 0.32 113.403 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.512 ' CG2' ' HD2' ' A' ' 64' ' ' ARG . 22.7 t -67.53 -36.67 77.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.199 0.523 . . . . 0.74 110.008 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.575 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 7.6 t80 -66.08 -37.31 85.46 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.792 -0.64 . . . . 0.31 109.438 171.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.726 HD12 ' HZ3' ' A' ' 23' ' ' LYS . 0.1 OUTLIER -58.22 -36.8 73.68 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 108.21 -1.033 . . . . 1.14 108.21 176.249 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.919 ' HB2' HD11 ' A' ' 55' ' ' LEU . 65.3 t30 -60.31 -30.91 69.8 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.133 -0.94 . . . . 1.14 110.302 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.722 ' HB3' HD21 ' A' ' 42' ' ' LEU . 50.5 mt -60.77 -39.53 89.15 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.831 -0.622 . . . . 1.07 112.008 -178.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.515 HD23 ' CD1' ' A' ' 89' ' ' PHE . 8.3 mp -57.68 -34.94 69.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.055 0.455 . . . . 1.73 110.807 -178.217 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.779 ' HZ2' ' HB3' ' A' ' 75' ' ' LYS . 0.3 OUTLIER -93.72 -6.02 47.13 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.209 -0.307 . . . . 2.47 110.828 -177.145 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -115.21 -27.87 7.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.516 -0.311 . . . . 2.68 111.759 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.509 HG22 ' HB ' ' A' ' 80' ' ' ILE . 13.8 t -58.0 117.68 21.29 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-O 122.011 0.91 . . . . 1.46 110.201 -177.385 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.509 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.1 Cg_exo -72.94 -15.71 26.16 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 123.511 2.808 . . . . 1.2 113.857 -161.11 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 40.0 t -105.96 5.5 30.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.672 0.273 . . . . 1.84 111.649 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.509 ' HB ' HG22 ' A' ' 77' ' ' THR . 34.0 mm -115.78 139.26 43.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.616 0.246 . . . . 1.93 110.792 -176.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 39.2 t -78.68 140.96 38.3 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.204 0.526 . . . . 2.06 110.863 -177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.29 -34.47 78.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 114.92 -1.036 . . . . 2.89 111.949 -175.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.78 -43.66 98.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.116 0.484 . . . . 2.06 110.551 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.15 -28.53 70.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.56 -0.746 . . . . 2.93 110.398 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.511 HD13 ' HB3' ' A' ' 74' ' ' LEU . 47.1 mm -69.88 -34.42 60.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.19 -0.914 . . . . 2.15 111.461 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.7 tmmm? -58.78 -34.85 71.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.093 0.473 . . . . 2.96 110.215 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.88 -31.31 67.93 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.922 -0.581 . . . . 1.7 111.087 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.448 ' HA ' ' HD3' ' A' ' 29' ' ' ARG . 34.8 mt -68.72 -67.82 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.625 0.602 . . . . 1.21 112.625 -173.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.542 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -112.29 -9.28 13.89 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.515 0.931 . . . . 1.16 113.515 -169.315 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.542 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 82.7 t80 -87.91 -24.87 23.5 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.076 0.465 . . . . 1.66 110.751 -174.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 24.2 mt -85.96 2.72 4.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.797 0.808 . . . . 1.23 109.864 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.579 ' OE2' ' HG ' ' A' ' 26' ' ' LEU . 45.7 tt0 -60.21 -27.61 67.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.145 -0.934 . . . . 2.67 111.519 -178.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -75.81 -60.8 2.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 4.89 111.643 -176.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.404 ' NE2' ' H ' ' A' ' 98' ' ' GLU . 0.0 OUTLIER 65.75 99.82 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.261 0.553 . . . . 3.67 111.695 -177.941 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -135.97 145.14 45.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.012 -0.54 . . . . 8.45 110.5 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 60.93 21.51 11.76 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.795 -0.638 . . . . 7.63 111.552 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . 0.401 ' HB3' ' NE2' ' A' ' 94' ' ' GLN . 14.8 t80 -151.24 -68.8 0.18 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.222 -0.659 . . . . 9.25 109.222 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.404 ' H ' ' NE2' ' A' ' 94' ' ' GLN . 33.2 mt-10 56.87 50.3 12.6 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 123.682 0.614 . . . . 10.06 111.3 169.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -119.35 -22.96 6.86 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.895 -0.593 . . . . 12.32 111.072 -174.282 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -83.16 71.52 10.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.195 0.522 . . . . 14.08 111.396 -175.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -89.98 89.92 7.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 15.92 110.756 177.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -90.35 -96.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.591 -0.277 . . . . 17.13 110.297 177.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -92.41 -11.67 34.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.624 0.726 . . . . 18.08 109.764 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 . . . . . 0 C--O 1.246 0.9 0 CA-C-N 114.93 -1.032 . . . . 19.89 108.984 179.279 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' P' P ' 600' ' ' ' A' . . . . . 0.648 " H5'" HD12 ' A' ' 55' ' ' LEU . . . . . . . . 0 O5'--C5' 1.424 -0.997 1 C3'-C2'-C1' 97.849 -4.057 . 0.0 '__' . 2.98 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 601' ' ' ' U' . . . . . 0.975 " H4'" ' HE1' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.511 -1.27 1 C4'-C3'-C2' 96.523 -6.177 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' P' P ' 602' ' ' ' C' . . . . . 0.64 " O2'" " H3'" ' P' ' 603' ' ' ' G' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 O4'-C4'-C3' 103.078 -1.73 . 0.0 OUTLIER delta-1 7.67 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' P' P ' 603' ' ' ' G' . . . . . 0.64 " H3'" " O2'" ' P' ' 602' ' ' ' C' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C4'-C3'-C2' 103.474 0.774 . 0.0 OUTLIER . 7.9 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.199 -0.36 . . . . 9.67 112.199 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.49 -48.19 61.44 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.477 -0.564 . . . . 8.13 109.477 175.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 75.6 mmm -132.16 -83.66 0.49 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.334 -0.848 . . . . 7.59 109.378 170.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 42.69 51.14 5.04 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 124.02 0.825 . . . . 4.97 111.694 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -77.73 145.27 36.63 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.387 0.613 . . . . 4.1 110.801 -177.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -92.42 57.13 2.91 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.439 -0.801 . . . . 1.79 111.14 -178.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.411 ' HB2' ' HB3' ' A' ' 10' ' ' LYS . 0.3 OUTLIER -63.24 119.28 9.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.663 -0.495 . . . . 1.67 109.663 175.628 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -49.54 -47.97 48.67 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.098 0.407 . . . . 2.09 112.098 -167.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.83 -51.09 63.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.822 0.344 . . . . 2.17 110.915 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.411 ' HB3' ' HB2' ' A' ' 7' ' ' SER . 34.3 tttm -55.28 -48.11 74.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.725 -0.67 . . . . 3.07 110.793 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.557 ' HA ' ' HG2' ' A' ' 14' ' ' GLU . 72.2 t -60.33 -53.41 49.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.845 -0.616 . . . . 0.39 110.302 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.43 ' HB3' ' CB ' ' A' ' 28' ' ' ALA . . . -53.86 -39.29 65.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.261 0.553 . . . . 1.1 111.256 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.43 -45.46 76.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.494 -0.775 . . . . 0.86 110.625 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 0.557 ' HG2' ' HA ' ' A' ' 11' ' ' VAL . 15.4 pt-20 -76.39 -26.54 55.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.151 -0.477 . . . . 2.05 112.06 -176.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.646 HD11 HD22 ' A' ' 43' ' ' LEU . 28.3 mm -56.34 -53.75 36.26 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 N-CA-C 108.946 -0.761 . . . . 1.05 108.946 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.65 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 22.0 p -66.52 -33.87 76.64 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.148 -0.933 . . . . 0.39 111.076 -178.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 74.0 t80 -58.61 -41.7 86.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.054 -0.521 . . . . 0.7 110.451 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 52.7 mtt180 -77.74 -31.97 52.44 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.351 -0.386 . . . . 3.55 110.859 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.474 ' N ' HD21 ' A' ' 19' ' ' LEU . 0.7 OUTLIER -82.67 -20.48 36.11 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.068 -0.515 . . . . 1.66 111.629 -174.688 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 58.64 33.93 23.45 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.12 -1.067 . . . . 2.19 108.12 -164.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.65 ' HB2' ' HA ' ' A' ' 16' ' ' SER . 0.3 OUTLIER -61.58 130.68 92.27 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 113.375 -1.739 . . . . 1.67 112.396 -173.203 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -72.57 -33.04 8.99 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 124.125 3.217 . . . . 0.41 113.47 172.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.552 ' HZ2' HD12 ' A' ' 71' ' ' LEU . 42.6 pttt -113.35 67.81 0.67 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.084 0.945 . . . . 2.03 109.679 -174.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -66.16 -17.8 64.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.32 -1.309 . . . . 2.27 111.49 -172.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -76.19 -39.39 54.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.316 -0.402 . . . . 2.14 110.359 175.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.461 HD21 ' O ' ' A' ' 26' ' ' LEU . 5.2 tt -73.58 -36.49 65.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.797 -0.446 . . . . 2.02 109.797 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.424 HD13 ' HA ' ' A' ' 27' ' ' ILE . 1.9 tp -65.77 -27.51 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.626 -0.509 . . . . 1.18 109.626 176.006 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.705 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.3 -34.57 63.54 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.318 0.58 . . . . 1.03 110.363 171.635 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.425 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 16.7 ttm180 -61.37 -47.82 84.1 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.498 -0.774 . . . . 1.96 111.5 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.7 p -58.49 -37.26 63.35 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.082 0 N-CA-C 109.73 -0.47 . . . . 1.15 109.73 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.705 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 41.1 t -52.57 -53.57 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.426 -0.807 . . . . 0.22 110.371 173.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.87 -42.41 99.75 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.347 -0.842 . . . . 4.21 111.052 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 32.7 mt -75.38 -52.15 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 113.312 0.856 . . . . 1.5 113.312 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.647 HD13 ' HG3' ' A' ' 38' ' ' LYS . 31.4 pt -82.3 -21.99 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.195 -0.602 . . . . 1.12 111.083 -176.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.33 146.45 9.24 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.584 -0.817 . . . . 0.28 111.438 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -63.42 -40.3 96.82 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 122.394 0.278 . . . . 0.99 111.519 -177.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.744 ' HD2' ' H ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -72.26 -34.01 67.92 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.802 -0.359 . . . . 3.52 110.991 178.694 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.647 ' HG3' HD13 ' A' ' 34' ' ' ILE . 14.6 tppt? -61.7 -42.0 98.35 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 110.145 -0.317 . . . . 3.03 110.145 176.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.457 ' O ' HD23 ' A' ' 43' ' ' LEU . . . -60.44 -42.39 96.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.051 -0.522 . . . . 0.89 110.49 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 41.9 mm -61.37 -42.6 94.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.89 -0.595 . . . . 1.78 110.625 177.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.53 ' HG3' ' O ' ' A' ' 37' ' ' LYS . 46.9 mt-10 -61.22 -38.23 85.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.236 -0.438 . . . . 2.1 110.429 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.954 HD23 ' HB3' ' A' ' 73' ' ' LEU . 75.3 mt -65.41 -31.04 71.93 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.105 -0.498 . . . . 1.09 111.378 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.646 HD22 HD11 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -62.35 -28.93 70.1 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.922 -0.486 . . . . 2.0 110.793 175.898 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.8 mtp -75.4 -35.21 61.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.322 0.582 . . . . 2.68 109.794 171.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.564 ' HB2' HD11 ' A' ' 73' ' ' LEU . 11.0 mm-40 -70.04 -26.8 64.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.536 -0.756 . . . . 1.83 111.461 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 43.3 p -57.01 -47.58 80.53 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.365 -0.606 . . . . 1.5 109.365 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.503 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -64.57 -35.81 82.18 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.837 -0.619 . . . . 1.4 110.914 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.651 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 21.9 tp10 -59.2 -49.3 78.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.925 -0.579 . . . . 2.51 109.566 176.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 79.7 t -70.58 -33.38 53.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.184 -0.462 . . . . 0.76 110.821 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.702 ' HA ' HH22 ' A' ' 64' ' ' ARG . 6.4 mm-40 -59.94 -34.48 73.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.6 -0.273 . . . . 1.96 111.612 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.651 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.1 pt20 -83.1 -24.03 32.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 2.48 110.644 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -88.8 -27.59 21.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 2.4 111.176 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.58 50.27 38.26 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 115.745 -0.661 . . . . 1.65 113.352 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -132.28 121.24 2.94 Favored Glycine 0 C--O 1.223 -0.55 0 C-N-CA 119.706 -1.235 . . . . 1.25 114.225 -177.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.819 HD22 ' HB2' ' A' ' 72' ' ' ASN . 1.9 tm? -165.23 125.51 1.88 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.885 0.374 . . . . 2.02 110.165 171.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.513 ' N ' HD21 ' A' ' 55' ' ' LEU . 90.1 m-85 -119.16 113.73 21.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.77 -0.826 . . . . 3.65 108.77 171.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.761 HD11 " O2'" ' P' ' 601' ' ' ' U' . 0.2 OUTLIER -87.37 -161.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.72 -0.673 . . . . 1.28 111.976 -175.493 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 1.011 ' HE1' " H4'" ' P' ' 601' ' ' ' U' . 3.2 mtt -44.49 -48.71 10.1 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 123.759 0.662 . . . . 1.44 110.949 -175.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.432 HD21 ' H ' ' A' ' 61' ' ' SER . 1.1 p-10 -107.98 -28.32 9.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.738 -0.665 . . . . 2.28 111.338 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.88 -18.84 37.14 Favored Glycine 0 C--O 1.224 -0.505 0 C-N-CA 120.853 -0.689 . . . . 1.21 112.888 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.432 ' H ' HD21 ' A' ' 59' ' ' ASN . 40.5 m -56.76 -45.95 81.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.161 0.43 . . . . 2.35 112.161 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.66 ' HB2' HD13 ' A' ' 57' ' ' ILE . 35.2 mtp180 -84.43 43.17 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.932 0.873 . . . . 3.36 109.326 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.408 HH11 ' HD3' ' A' ' 63' ' ' ARG . 38.4 ttp180 -47.01 130.06 12.17 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 113.552 -1.658 . . . . 4.14 112.611 -170.827 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.702 HH22 ' HA ' ' A' ' 50' ' ' GLU . 0.1 OUTLIER 64.13 71.82 0.47 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.248 -0.887 . . . . 2.6 112.822 -178.274 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.852 HG21 ' HA2' ' A' ' 68' ' ' GLY . 3.1 t -90.49 140.76 26.88 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 107.973 -1.121 . . . . 1.26 107.973 166.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -47.7 -58.16 1.9 Allowed 'Trans proline' 0 N--CA 1.48 0.72 0 C-N-CA 123.581 2.854 . . . . 0.51 113.262 -171.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.658 ' HA2' ' O4 ' ' P' ' 601' ' ' ' U' . . . -69.29 -40.33 81.07 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.284 -0.96 . . . . 0.29 111.245 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.852 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -55.97 -28.2 52.75 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.515 -0.342 . . . . 0.32 113.075 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.548 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 70.4 t -63.09 -39.02 83.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.144 0.497 . . . . 0.74 110.69 176.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.452 ' CG ' HD12 ' A' ' 19' ' ' LEU . 6.9 t80 -66.32 -34.84 78.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.219 -0.446 . . . . 0.31 110.022 172.06 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.654 HD11 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -55.3 -33.52 63.35 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 108.658 -0.867 . . . . 1.14 108.658 176.705 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.819 ' HB2' HD22 ' A' ' 55' ' ' LEU . 27.8 t-20 -56.06 -40.53 73.68 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.954 -0.566 . . . . 1.14 109.976 174.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.954 ' HB3' HD23 ' A' ' 42' ' ' LEU . 34.5 mt -67.91 -38.15 82.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.599 -0.728 . . . . 1.07 111.031 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.657 ' O ' HD11 ' A' ' 85' ' ' ILE . 5.0 tt -57.56 -38.95 75.63 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.817 -1.083 . . . . 1.73 109.734 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.656 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 12.6 pttt -93.89 -31.22 14.41 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.757 0.651 . . . . 2.47 112.757 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 72' ' ' ASN . 0.9 OUTLIER -97.28 19.97 12.26 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.838 0.31 . . . . 2.68 111.838 -174.948 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.661 HG23 HD11 ' A' ' 80' ' ' ILE . 4.1 t -68.44 120.2 73.48 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 109.118 -0.697 . . . . 1.46 109.118 172.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.515 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 9.3 Cg_exo -71.8 -9.47 24.87 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 123.077 2.518 . . . . 1.2 114.029 -166.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 77.3 p -111.23 1.25 17.09 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.118 0.414 . . . . 1.84 112.118 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.661 HD11 HG23 ' A' ' 77' ' ' THR . 47.3 mt -119.93 140.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 1.93 111.493 -175.859 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.3 t -82.46 154.75 24.97 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.566 0.698 . . . . 2.06 111.003 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.413 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 27.9 tt0 -60.71 -34.06 73.81 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.466 -1.243 . . . . 2.89 113.182 -167.911 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -63.0 -46.91 85.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.842 0.312 . . . . 2.06 111.842 -175.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.96 -32.55 72.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.209 0.528 . . . . 2.93 109.997 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.657 HD11 ' O ' ' A' ' 74' ' ' LEU . 30.8 mm -61.57 -44.93 99.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.169 -0.923 . . . . 2.15 110.963 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.562 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 36.4 ttpt -57.25 -40.69 78.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.505 -0.77 . . . . 2.96 111.516 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.92 -31.34 72.53 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.778 -0.646 . . . . 1.7 110.971 -174.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.443 HD11 HD23 ' A' ' 74' ' ' LEU . 44.8 mt -70.0 -71.37 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.601 0.593 . . . . 1.21 112.601 -175.064 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.654 ' HD1' HD11 ' A' ' 71' ' ' LEU . 0.0 OUTLIER -110.57 -15.7 13.82 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.419 0.896 . . . . 1.16 113.419 -168.368 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.562 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 81.7 t80 -71.58 -27.32 63.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.378 0.608 . . . . 1.66 110.614 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 43.2 mt -72.51 -9.81 13.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.467 -0.788 . . . . 1.23 111.174 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . 0.509 ' OE2' ' HD3' ' A' ' 23' ' ' LYS . 50.3 tt0 -61.82 -44.14 97.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.66 0.267 . . . . 2.67 111.099 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -103.7 -38.13 7.21 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.786 -0.365 . . . . 4.89 111.326 -178.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 62.0 -78.29 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.171 0.588 . . . . 3.67 112.296 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -150.53 103.17 3.1 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.443 -0.577 . . . . 8.45 109.443 -178.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -92.1 120.06 32.36 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.645 0.736 . . . . 7.63 112.11 -172.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -81.83 81.72 7.75 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.698 -1.137 . . . . 9.25 110.954 171.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 75.5 tt0 -117.0 142.63 46.7 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.294 -0.632 . . . . 10.06 109.294 178.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.505 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . 0.9 OUTLIER -89.65 -35.08 16.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.99 0.367 . . . . 12.32 111.99 -175.128 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm 61.41 26.15 15.97 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.691 -0.686 . . . . 14.08 112.335 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.505 ' HG3' ' HB3' ' A' ' 99' ' ' ASN . 33.8 mtmm -81.01 54.44 2.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.188 0.518 . . . . 15.92 110.472 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -110.72 119.3 38.68 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.205 -0.452 . . . . 17.13 110.862 -177.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.78 80.25 0.21 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.623 -0.717 . . . . 18.08 112.329 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.801 -0.618 . . . . 19.89 109.653 174.796 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' P' P ' 600' ' ' ' A' . . . . . 0.648 " O5'" ' HB2' ' A' ' 71' ' ' LEU . . . . . . . . 0 C3'--C2' 1.515 -0.945 1 C3'-C2'-C1' 97.801 -4.11 . 0.0 '__' . 2.98 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 601' ' ' ' U' . . . . . 1.011 " H4'" ' HE1' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.507 -1.624 1 C4'-C3'-C2' 95.84 -6.86 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' P' P ' 602' ' ' ' C' . . . . . 0.64 H5'' ' HE2' ' A' ' 58' ' ' MET . . . . . . . . 0 O5'--C5' 1.424 -0.989 0 C3'-C2'-C1' 100.394 -1.229 . 0.0 OUTLIER delta-1 7.67 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.909 0 O4'-C1'-N19 108.971 0.771 . 0.0 OUTLIER . 7.9 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.784 0 N-CA-C 112.222 -0.351 . . . . 9.67 112.222 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.7 165.61 11.04 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 110.178 -0.304 . . . . 8.13 110.178 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 63.5 mtm -97.54 69.14 2.18 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.583 -0.525 . . . . 7.59 109.583 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.64 59.63 0.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.715 -0.675 . . . . 4.97 110.897 -176.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -70.43 -29.09 65.6 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.095 -0.706 . . . . 4.1 109.095 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -76.91 73.25 3.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.051 -0.977 . . . . 1.79 110.69 176.469 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.2 m -72.28 130.37 40.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.317 -0.856 . . . . 1.67 110.27 179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.552 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 52.5 mt-30 -47.91 -47.6 32.11 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.275 0.843 . . . . 2.09 113.275 -169.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -67.69 -39.15 84.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.751 0.31 . . . . 2.17 111.259 -176.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -70.11 -36.43 74.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.429 -0.35 . . . . 3.07 110.576 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 85.9 t -58.14 -41.38 80.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.194 -0.457 . . . . 0.39 110.794 177.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -44.27 82.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.029 0.443 . . . . 1.1 111.157 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.06 -33.78 72.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.977 -0.556 . . . . 0.86 110.203 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -63.01 -43.9 97.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.645 -0.707 . . . . 2.05 110.647 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.69 HD11 HD13 ' A' ' 43' ' ' LEU . 5.0 mm -64.72 -51.0 72.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 N-CA-C 109.894 -0.41 . . . . 1.05 109.894 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.448 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 16.3 p -62.98 -40.55 98.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.39 111.267 -174.604 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -61.92 -45.16 94.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.7 111.178 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -74.2 -34.23 63.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.748 0.308 . . . . 3.55 111.785 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.459 ' HB3' ' HA3' ' A' ' 67' ' ' GLY . 29.1 mt -82.49 -13.84 56.01 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.441 -0.345 . . . . 1.66 111.915 -176.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 61.51 32.04 18.85 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 108.333 -0.988 . . . . 2.19 108.333 -170.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.725 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 7.6 tp10 -59.39 116.44 16.29 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 114.135 -1.393 . . . . 1.67 112.171 -172.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.5 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 59.9 Cg_endo -67.07 -46.58 2.99 Favored 'Trans proline' 0 N--CA 1.472 0.26 0 C-N-CA 124.066 3.177 . . . . 0.41 113.049 173.005 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.613 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 41.7 pttt -100.88 67.91 1.25 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.737 0.779 . . . . 2.03 109.894 -175.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.33 -17.95 56.25 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.128 -0.942 . . . . 2.27 112.255 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -57.54 -40.74 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 2.14 110.182 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.666 HD23 ' HA ' ' A' ' 89' ' ' PHE . 3.2 tm? -73.02 -45.52 57.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.396 -0.82 . . . . 2.02 110.334 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.725 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.0 tp -68.05 -28.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.997 -0.547 . . . . 1.18 111.083 -175.022 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.631 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.45 -34.67 60.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.41 . . . . 1.03 110.563 172.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 12.6 ttm180 -63.08 -45.98 89.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 1.96 111.476 -178.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 12.5 p -55.64 -38.69 51.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.094 0.473 . . . . 1.15 109.878 -179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.631 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 65.3 t -54.87 -50.64 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.167 -0.924 . . . . 0.22 110.571 173.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.09 -40.81 95.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.141 -0.936 . . . . 4.21 110.959 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 39.1 mm -74.42 -48.54 35.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 115.993 -0.549 . . . . 1.5 112.236 -175.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 32.0 pt -91.33 -29.1 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 120.379 -0.529 . . . . 1.12 112.288 -174.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.15 161.88 11.83 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.561 -0.828 . . . . 0.28 112.612 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.552 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 2.5 p-10 -65.07 -52.67 54.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.785 0.326 . . . . 0.99 111.72 -178.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -71.63 -32.9 68.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.924 0.392 . . . . 3.52 110.396 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -67.8 -29.91 69.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 3.03 111.056 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.69 -39.99 84.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 0.89 110.178 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 30.2 mt -69.34 -32.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.517 . . . . 1.78 110.911 176.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -58.72 -38.55 78.58 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.099 -0.334 . . . . 2.1 110.099 173.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.831 ' HB3' HD12 ' A' ' 73' ' ' LEU . 68.4 mt -71.41 -35.2 70.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.431 -0.35 . . . . 1.09 110.204 174.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.69 HD13 HD11 ' A' ' 15' ' ' ILE . 41.1 mt -63.99 -29.93 71.05 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.201 0.524 . . . . 2.0 111.545 176.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.8 tpp -75.97 -35.32 59.7 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.327 0.584 . . . . 2.68 109.684 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -69.87 -34.38 73.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.292 -0.867 . . . . 1.83 111.501 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 1.057 HG22 HD13 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -52.0 -36.61 50.42 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 112.097 0.406 . . . . 1.5 112.097 -176.451 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.51 85.4 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.628 0.233 . . . . 1.4 111.628 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.45 -30.6 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.402 0.62 . . . . 2.51 110.276 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.1 t -76.38 -44.86 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.363 -0.835 . . . . 0.76 110.546 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -56.14 -49.03 75.08 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.225 -0.898 . . . . 1.96 112.218 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -60.75 -29.37 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 2.48 111.906 -173.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -91.75 -25.22 19.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.976 0.417 . . . . 2.4 111.636 -177.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.08 -14.63 18.97 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.21 -0.519 . . . . 1.65 112.104 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 40.31 -81.91 0.0 OUTLIER Glycine 0 CA--C 1.528 0.899 0 N-CA-C 117.657 1.823 . . . . 1.25 117.657 167.249 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.753 ' HB3' ' HA ' ' A' ' 64' ' ' ARG . 2.8 tm? -74.85 132.01 41.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 115.252 1.575 . . . . 2.02 115.252 -156.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.553 ' N ' HD21 ' A' ' 55' ' ' LEU . 74.3 t80 -123.34 114.19 19.85 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.425 -1.261 . . . . 3.65 107.644 159.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.688 ' CG2' HD13 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -87.61 -172.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 114.125 1.158 . . . . 1.28 114.125 -168.611 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 1.021 ' HE1' " H4'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -55.39 -47.26 76.12 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 115.174 -0.921 . . . . 1.44 112.754 -172.056 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.705 HD21 ' N ' ' A' ' 60' ' ' GLY . 0.3 OUTLIER -91.62 -27.72 17.96 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 119.776 -0.77 . . . . 2.28 111.468 176.604 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . 0.705 ' N ' HD21 ' A' ' 59' ' ' ASN . . . 82.61 -13.44 41.71 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.904 -0.665 . . . . 1.21 113.768 176.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.2 m -46.37 -58.48 3.69 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 122.89 0.476 . . . . 2.35 111.833 -177.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 3.5 ptp180 -99.89 104.71 16.38 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.223 -0.658 . . . . 3.36 109.223 173.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -72.57 127.18 31.78 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.563 -0.455 . . . . 4.14 110.502 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.753 ' HA ' ' HB3' ' A' ' 55' ' ' LEU . 8.9 tpt85 71.22 98.74 0.07 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.968 -1.014 . . . . 2.6 112.814 175.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 1.016 HG21 ' HA2' ' A' ' 68' ' ' GLY . 1.1 t -109.31 147.85 36.83 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 114.268 -1.333 . . . . 1.26 108.862 168.241 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -51.51 -59.05 1.27 Allowed 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.124 2.55 . . . . 0.51 113.076 -175.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.58 ' O ' HD22 ' A' ' 71' ' ' LEU . . . -66.22 -36.27 91.55 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.294 -0.955 . . . . 0.29 110.721 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 1.016 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.18 -32.06 59.74 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.911 -0.645 . . . . 0.32 112.927 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.639 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 0.4 OUTLIER -65.26 -32.57 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 117.459 0.63 . . . . 0.74 110.101 -178.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.576 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 18.6 t80 -67.42 -37.67 83.41 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.571 -0.529 . . . . 0.31 109.571 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.582 HD13 " O5'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -62.37 -34.78 77.36 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.381 -1.34 . . . . 1.14 107.381 176.549 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.649 ' HB2' HD22 ' A' ' 55' ' ' LEU . 65.7 t30 -59.67 -31.4 69.51 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 115.19 -0.914 . . . . 1.14 109.852 175.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 1.057 HD13 HG22 ' A' ' 46' ' ' THR . 87.8 mt -62.02 -33.1 73.73 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 115.683 -0.69 . . . . 1.07 111.956 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.568 ' O ' HD11 ' A' ' 85' ' ' ILE . 42.1 mt -64.32 -21.28 66.56 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.381 -0.528 . . . . 1.73 110.395 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.521 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -85.19 -15.29 44.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 2.47 110.641 173.468 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -115.02 4.45 14.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 2.68 111.428 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.564 HG21 ' HB ' ' A' ' 80' ' ' ILE . 9.7 t -72.93 114.34 29.82 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 121.758 0.79 . . . . 1.46 109.968 -175.496 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.482 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 6.2 Cg_exo -72.94 -22.16 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 123.039 2.492 . . . . 1.2 113.499 -165.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 30.2 m -112.85 17.4 19.01 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.09 0.774 . . . . 1.84 113.09 -173.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.564 ' HB ' HG21 ' A' ' 77' ' ' THR . 41.0 mm -118.3 135.9 57.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.115 0.484 . . . . 1.93 111.724 -177.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.3 p -75.89 148.91 37.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.743 -0.662 . . . . 2.06 110.344 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -57.06 -34.48 68.3 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.848 -1.069 . . . . 2.89 112.962 -169.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -70.29 -42.69 71.72 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.144 -0.222 . . . . 2.06 111.309 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 25.3 mt-30 -60.93 -34.46 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.934 0.397 . . . . 2.93 110.13 177.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.568 HD11 ' O ' ' A' ' 74' ' ' LEU . 60.4 mt -60.69 -51.15 76.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 2.15 110.049 175.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.539 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 27.1 ttpt -54.64 -42.47 71.29 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.831 -0.622 . . . . 2.96 110.512 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.44 -35.96 79.03 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.183 -0.917 . . . . 1.7 111.714 -175.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 62.9 mt -70.94 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 112.273 0.471 . . . . 1.21 112.273 -177.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.666 ' HA ' HD23 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -103.4 -18.9 14.63 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.613 0.968 . . . . 1.16 113.613 -166.683 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.539 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 60.4 t80 -77.05 -38.94 51.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.864 0.364 . . . . 1.66 110.632 -175.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.565 ' HA ' ' HB2' ' A' ' 94' ' ' GLN . 43.4 mt -68.49 -17.05 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.251 0.548 . . . . 1.23 110.843 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -66.71 -33.5 75.77 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.58 -0.526 . . . . 2.67 109.58 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -85.83 -36.58 19.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.207 0.527 . . . . 4.89 109.971 175.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . 0.565 ' HB2' ' HA ' ' A' ' 91' ' ' ILE . 15.5 mm100 -78.87 78.25 5.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.487 -0.779 . . . . 3.67 111.756 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -85.82 -49.55 7.82 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.05 -0.523 . . . . 8.45 109.742 175.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 60.7 tt0 54.56 93.43 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.707 0.629 . . . . 7.63 112.497 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -117.48 136.98 52.84 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.857 -0.423 . . . . 9.25 109.857 177.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.1 mp0 -81.11 141.14 34.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.374 -0.376 . . . . 10.06 110.113 178.132 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -135.87 27.61 3.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.414 -0.357 . . . . 12.32 111.352 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -126.46 30.13 5.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.423 -0.353 . . . . 14.08 111.357 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt 66.83 84.38 0.16 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.834 -0.621 . . . . 15.92 111.417 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -100.95 84.74 2.73 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.981 -0.554 . . . . 17.13 109.824 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.04 112.94 5.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 18.08 111.148 -178.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.664 -0.684 . . . . 19.89 109.193 179.76 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' P' P ' 600' ' ' ' A' . . . . . 0.425 " H2'" ' CE1' ' A' ' 89' ' ' PHE . . . . . . . . 0 C3'--C2' 1.515 -0.904 0 C3'-C2'-C1' 98.095 -3.784 . 0.0 '__' . 2.98 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' P' P ' 601' ' ' ' U' . . . . . 1.021 " H4'" ' HE1' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.509 -1.474 1 C4'-C3'-C2' 96.488 -6.212 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' P' P ' 602' ' ' ' C' . . . . . 0.805 ' O2 ' " H2'" ' P' ' 602' ' ' ' C' . . . . . . . . 0 O5'--C5' 1.429 -0.719 0 P-O3'-C3' 121.855 1.795 . 0.0 OUTLIER delta-1 7.67 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C3'-C2'-C1' 100.742 -0.843 . 0.0 OUTLIER gamma 7.9 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.809 0 N-CA-C 112.058 -0.417 . . . . 9.67 112.058 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -121.95 110.1 15.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.711 0.291 . . . . 8.13 110.841 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -121.18 71.63 0.96 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.497 0.665 . . . . 7.59 111.053 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.05 43.66 1.19 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.851 -0.613 . . . . 4.97 109.541 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 63.57 -89.39 0.03 OUTLIER 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.158 -0.928 . . . . 4.1 110.464 -174.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -94.05 66.39 3.55 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.032 0.92 . . . . 1.79 109.33 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 14.8 m -58.95 128.55 37.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.873 -1.058 . . . . 1.67 110.242 178.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.805 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 49.9 mt-30 -53.23 -34.15 55.91 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.551 -0.75 . . . . 2.09 112.229 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.2 -48.21 68.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.833 0.349 . . . . 2.17 110.529 178.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -70.1 -35.85 74.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 3.07 110.727 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 75.0 t -57.88 -56.49 15.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.05 -0.352 . . . . 0.39 110.05 176.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.43 -37.82 70.73 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.356 0.598 . . . . 1.1 110.962 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -61.57 -39.07 89.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.284 -0.871 . . . . 0.86 111.161 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -77.78 -41.2 38.21 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.034 0.383 . . . . 2.05 112.034 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.0 mm -55.91 -50.85 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.029 0.443 . . . . 1.05 110.336 -175.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.615 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 7.8 p -57.59 -39.59 77.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.396 -0.82 . . . . 0.39 111.313 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -66.46 -45.58 79.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.116 -0.493 . . . . 0.7 110.88 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 34.2 mtp180 -65.42 -43.21 91.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.91 -0.586 . . . . 3.55 111.723 -175.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.59 HD11 ' HA3' ' A' ' 67' ' ' GLY . 3.3 mm? -83.05 -7.57 59.64 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.14 0.422 . . . . 1.66 112.14 -178.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 56.16 37.18 28.58 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.009 -1.108 . . . . 2.19 108.009 -169.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.794 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 5.5 tp10 -60.84 117.02 21.37 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 113.168 -1.833 . . . . 1.67 111.309 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.438 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 48.9 Cg_endo -64.16 -44.17 13.02 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 123.708 2.939 . . . . 0.41 112.862 174.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.664 ' HE2' ' C5 ' ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -104.49 72.37 1.04 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.74 1.257 . . . . 2.03 110.014 -175.792 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -66.12 -18.38 65.31 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.565 -1.652 . . . . 2.27 112.707 -167.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.21 -33.08 69.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.124 0.487 . . . . 2.14 109.732 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.887 HD13 ' HA ' ' A' ' 89' ' ' PHE . 8.7 tt -73.95 -40.51 63.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 2.02 110.26 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.794 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.9 tp -62.97 -29.73 47.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.651 -0.499 . . . . 1.18 109.651 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.668 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.37 -34.74 63.42 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.403 0.62 . . . . 1.03 110.285 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.9 ttm180 -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.556 -0.747 . . . . 1.96 111.125 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 19.9 t -53.22 -46.37 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 N-CA-C 109.114 -0.698 . . . . 1.15 109.114 176.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.668 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -52.84 -50.33 43.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.153 -1.385 . . . . 0.22 111.337 175.374 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 -61.02 -49.7 76.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.733 -0.667 . . . . 4.21 111.627 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 35.8 mt -73.89 -51.94 22.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.713 0.634 . . . . 1.5 112.713 -171.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 28.8 pt -83.81 -28.68 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.058 -0.657 . . . . 1.12 111.328 -176.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.97 149.8 8.64 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.596 -0.811 . . . . 0.28 111.66 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.805 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 1.6 p-10 -60.32 -41.34 93.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.078 0.399 . . . . 0.99 112.078 -177.33 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -71.79 -34.81 69.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.005 0.431 . . . . 3.52 110.237 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.839 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 21.5 mtpp -69.69 -25.03 63.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.122 -0.49 . . . . 3.03 110.992 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.64 -36.42 80.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.199 0.523 . . . . 0.89 109.606 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.41 -40.78 64.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.588 -0.733 . . . . 1.78 111.441 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.839 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 12.8 pt-20 -67.17 -31.81 72.48 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.726 -0.39 . . . . 2.1 110.443 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.797 ' HB3' HD12 ' A' ' 73' ' ' LEU . 28.6 mt -69.39 -41.91 75.84 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.349 -0.612 . . . . 1.09 109.349 171.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.415 ' HA ' HD11 ' A' ' 43' ' ' LEU . 0.9 OUTLIER -56.62 -32.85 65.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.811 -0.631 . . . . 2.0 111.808 -179.734 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 80.1 mtp -75.31 -42.36 54.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.136 0.493 . . . . 2.68 110.353 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -70.23 -25.05 63.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.799 -0.637 . . . . 1.83 111.369 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.584 HG22 HD13 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -56.04 -36.73 68.34 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 110.087 -0.338 . . . . 1.5 110.087 178.505 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.54 -34.4 77.83 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.075 -0.511 . . . . 1.4 110.975 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 43.9 mt-10 -71.12 -42.82 68.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.925 -0.58 . . . . 2.51 110.059 178.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.63 -33.39 63.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.013 -0.54 . . . . 0.76 109.813 176.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.434 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 3.7 tm-20 -61.66 -51.25 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.489 -0.778 . . . . 1.96 109.662 175.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.626 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.8 pt20 -64.84 -18.0 64.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.861 0.362 . . . . 2.48 111.3 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -99.06 -7.88 26.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.546 -0.297 . . . . 2.4 111.696 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.24 35.55 91.72 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 121.176 -0.535 . . . . 1.65 112.81 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -97.16 109.27 3.81 Favored Glycine 0 C--O 1.226 -0.358 0 C-N-CA 120.598 -0.81 . . . . 1.25 113.785 -174.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.866 HD22 ' HB2' ' A' ' 72' ' ' ASN . 2.6 tm? -176.82 124.47 0.15 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.122 0.487 . . . . 2.02 110.836 169.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.451 ' N ' HD21 ' A' ' 55' ' ' LEU . 97.2 m-85 -126.0 100.89 6.55 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.132 -1.062 . . . . 3.65 108.132 164.748 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.67 ' HA ' " O4'" ' P' ' 600' ' ' ' A' . 0.5 OUTLIER -72.03 -176.15 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.012 0.375 . . . . 1.28 112.012 -176.687 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.843 ' HE1' " H4'" ' P' ' 601' ' ' ' U' . 0.2 OUTLIER -41.22 -45.61 2.92 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.912 -1.04 . . . . 1.44 112.573 -179.414 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.581 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 0.1 OUTLIER -94.92 -34.88 12.24 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.551 0.575 . . . . 2.28 112.551 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.75 -17.08 32.77 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.422 -0.418 . . . . 1.21 113.181 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.581 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 68.6 m -64.12 -57.61 9.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.689 0.281 . . . . 2.35 111.683 -178.204 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -81.59 81.55 7.63 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.907 -0.775 . . . . 3.36 108.907 174.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -71.41 126.96 31.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.774 -0.648 . . . . 4.14 111.167 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.482 ' H ' HD11 ' A' ' 55' ' ' LEU . 0.1 OUTLIER 70.08 58.0 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.703 1.001 . . . . 2.6 113.703 172.618 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.797 HG21 ' HA2' ' A' ' 68' ' ' GLY . 3.7 t -78.64 143.33 62.95 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.221 -0.9 . . . . 1.26 109.152 169.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.423 ' O ' HD11 ' A' ' 19' ' ' LEU . 9.3 Cg_endo -46.25 -59.61 1.15 Allowed 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 124.134 3.222 . . . . 0.51 113.477 -174.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.59 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -68.25 -34.55 80.74 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.329 -0.939 . . . . 0.29 111.316 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.797 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.31 -38.65 79.58 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 114.981 -0.61 . . . . 0.32 112.114 177.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 22.0 t -59.67 -41.44 85.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.129 0.49 . . . . 0.74 110.204 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.634 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 21.1 t80 -65.73 -36.83 84.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.31 110.484 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.744 HD11 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -57.63 -36.77 72.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.755 -0.831 . . . . 1.14 108.755 176.819 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.866 ' HB2' HD22 ' A' ' 55' ' ' LEU . 66.5 t30 -63.05 -27.7 69.59 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.453 -0.794 . . . . 1.14 110.549 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.797 HD12 ' HB3' ' A' ' 42' ' ' LEU . 45.5 mt -58.22 -35.41 71.63 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.148 -0.478 . . . . 1.07 111.763 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.498 ' HB3' ' CG2' ' A' ' 85' ' ' ILE . 7.2 mp -64.4 -19.78 65.72 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.089 -0.505 . . . . 1.73 110.616 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.53 ' HD3' ' C8 ' ' P' ' 600' ' ' ' A' . 0.0 OUTLIER -82.66 -40.11 21.16 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.927 0.394 . . . . 2.47 110.151 175.655 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -89.04 11.19 19.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.775 -0.648 . . . . 2.68 110.872 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.56 HG23 ' HB ' ' A' ' 80' ' ' ILE . 14.7 t -64.28 131.79 95.14 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 121.752 0.787 . . . . 1.46 109.946 -177.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.5 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.5 Cg_exo -72.72 -47.5 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.284 2.656 . . . . 1.2 113.851 -169.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.2 m -113.53 16.76 18.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.499 0.926 . . . . 1.84 113.499 -172.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.56 ' HB ' HG23 ' A' ' 77' ' ' THR . 61.4 mt -119.1 138.92 48.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.57 -0.452 . . . . 1.93 111.172 -174.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.3 p -98.28 167.2 11.0 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.063 0.458 . . . . 2.06 111.861 -177.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -51.9 -48.64 64.04 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.14 1.163 . . . . 2.89 114.14 -167.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -68.07 -37.09 80.86 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.567 -0.453 . . . . 2.06 111.796 -173.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -62.22 -37.19 84.41 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.542 0.687 . . . . 2.93 109.26 175.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.498 ' CG2' ' HB3' ' A' ' 74' ' ' LEU . 82.4 mt -68.39 -49.49 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 114.637 -1.165 . . . . 2.15 110.934 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.533 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 39.3 ttmt -57.25 -41.45 79.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.887 -0.597 . . . . 2.96 111.538 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -60.11 -32.92 71.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.005 0.431 . . . . 1.7 111.161 -177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 51.8 mt -70.83 -70.84 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.941 -0.572 . . . . 1.21 112.318 -177.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.887 ' HA ' HD13 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -106.89 -12.9 15.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 113.254 0.835 . . . . 1.16 113.254 -164.585 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.533 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 76.3 t80 -90.28 -38.14 13.6 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.793 0.33 . . . . 1.66 110.911 -172.809 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 51.4 mt -69.25 -64.0 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.426 -0.352 . . . . 1.23 110.423 178.234 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 51.81 -90.92 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.783 0.833 . . . . 2.67 112.286 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -86.38 -22.1 26.81 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.131 -0.486 . . . . 4.89 111.434 -173.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 16.9 tt0 -56.71 128.56 37.08 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.153 0.501 . . . . 3.67 111.17 -174.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -100.45 111.29 23.53 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.538 -0.755 . . . . 8.45 110.453 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -92.86 -44.25 8.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.137 0.494 . . . . 7.63 110.247 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -98.87 75.85 2.11 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.295 0.569 . . . . 9.25 110.556 -177.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -82.57 -54.73 4.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.242 -0.89 . . . . 10.06 109.193 175.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 32.0 p-10 -121.93 178.02 5.06 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.466 -1.243 . . . . 12.32 109.258 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 97.9 mttt 56.7 44.53 23.5 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.625 0.726 . . . . 14.08 110.289 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.426 ' C ' ' H ' ' A' ' 103' ' ' ALA . 45.0 mtpt -81.27 6.26 14.69 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.033 -0.985 . . . . 15.92 111.367 -175.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 73.01 -31.28 0.22 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.74 0.816 . . . . 17.13 112.478 175.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . 0.426 ' H ' ' C ' ' A' ' 101' ' ' LYS . . . -57.25 -58.49 7.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.621 0.248 . . . . 18.08 110.784 179.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.573 -0.727 . . . . 19.89 110.093 176.327 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' P' P ' 600' ' ' ' A' . . . . . 0.67 " O4'" ' HA ' ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.425 -0.963 0 C4'-C3'-C2' 100.702 -1.998 . 0.0 '__' . 2.98 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' P' P ' 601' ' ' ' U' . . . . . 0.843 " H4'" ' HE1' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.509 -1.414 1 C4'-C3'-C2' 97.216 -5.484 OUTLIER-DELTA 0.0 OUTLIER gamma 0.86 . . . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' P' P ' 602' ' ' ' C' . . . . . 0.534 ' OP1' ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 C4'-C3'-C2' 105.913 3.213 OUTLIER-DELTA 0.0 OUTLIER . 7.67 . . . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 C4'-C3'-C2' 105.471 2.771 . 0.0 OUTLIER . 7.9 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 112.31 -0.316 . . . . 9.67 112.31 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.92 116.85 33.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.99 0.424 . . . . 8.13 110.03 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 13.9 tpt -79.63 -63.92 1.3 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.189 -0.46 . . . . 7.59 109.913 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 51.22 79.91 0.09 Allowed 'General case' 0 C--O 1.233 0.222 0 O-C-N 123.826 0.704 . . . . 4.97 111.126 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -63.04 127.83 33.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.17 -0.468 . . . . 4.1 111.075 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -101.61 82.52 2.3 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.325 -0.62 . . . . 1.79 109.325 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 39.1 t -63.31 119.23 9.25 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.648 -0.501 . . . . 1.67 109.648 178.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.806 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 16.1 mt-30 -55.87 -29.89 60.66 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.346 0.498 . . . . 2.09 112.346 -173.635 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -65.38 -50.17 66.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.084 0.469 . . . . 2.17 110.287 176.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.539 ' HE3' ' HB3' ' A' ' 13' ' ' ASP . 0.3 OUTLIER -70.25 -37.45 74.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.918 -0.583 . . . . 3.07 109.885 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 69.5 t -57.14 -47.62 83.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.228 -0.286 . . . . 0.39 110.228 177.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.23 -42.86 70.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.206 0.527 . . . . 1.1 111.029 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.539 ' HB3' ' HE3' ' A' ' 10' ' ' LYS . 35.8 t70 -70.37 -39.73 74.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.687 -0.688 . . . . 0.86 110.537 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -61.46 -45.2 95.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.118 -0.947 . . . . 2.05 111.292 -177.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.551 ' CD1' HD23 ' A' ' 43' ' ' LEU . 5.2 mm -59.98 -52.17 64.33 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-O 121.067 0.461 . . . . 1.05 109.925 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.49 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 19.4 p -64.95 -38.88 92.45 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.642 -0.708 . . . . 0.39 111.32 -175.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -59.23 -45.61 90.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.783 -0.644 . . . . 0.7 110.949 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 75.0 mtt180 -79.04 -33.7 44.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.603 -0.272 . . . . 3.55 111.529 -177.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.953 HD11 ' HA3' ' A' ' 67' ' ' GLY . 4.2 mm? -79.29 -9.4 59.57 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.445 0.535 . . . . 1.66 112.445 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 58.57 34.65 24.03 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 108.079 -1.082 . . . . 2.19 108.079 -171.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.578 ' HG2' ' O4 ' ' P' ' 601' ' ' ' U' . 1.3 tm-20 -71.8 126.07 91.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 114.089 -1.414 . . . . 1.67 111.91 -165.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.422 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 73.6 Cg_endo -69.93 -46.65 1.08 Allowed 'Trans proline' 0 N--CA 1.476 0.463 0 C-N-CA 124.657 3.571 . . . . 0.41 114.345 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.689 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 33.0 pttt -109.85 66.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.382 0.611 . . . . 2.03 110.494 -169.012 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -59.32 -12.44 5.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.523 -1.217 . . . . 2.27 113.411 -167.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.13 -46.61 86.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.374 0.607 . . . . 2.14 109.662 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.63 HD13 ' HA ' ' A' ' 89' ' ' PHE . 6.6 tt -73.36 -41.57 63.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.289 -0.868 . . . . 2.02 110.812 -177.065 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.525 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 6.4 tp -65.87 -30.04 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 121.004 0.43 . . . . 1.18 110.413 -177.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.713 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.18 -33.82 63.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.579 0.704 . . . . 1.03 110.333 173.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.7 ttm180 -63.03 -39.15 93.89 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.296 -0.865 . . . . 1.96 111.763 -179.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 23.1 t -52.78 -43.16 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.128 -0.693 . . . . 1.15 109.128 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.713 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.0 t -53.18 -50.07 48.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.278 -1.328 . . . . 0.22 110.855 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -59.49 -43.82 93.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.22 -0.9 . . . . 4.21 111.429 -177.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 38.9 mm -75.55 -49.73 26.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.672 . . . . 1.5 112.5 -173.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.43 ' O ' ' HG3' ' A' ' 38' ' ' LYS . 36.4 pt -94.76 -29.07 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.604 0.594 . . . . 1.12 112.604 -172.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.33 162.17 10.81 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.556 -0.83 . . . . 0.28 112.673 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.806 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 20.4 p-10 -67.59 -55.99 11.21 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.515 0.326 . . . . 0.99 111.667 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.56 -33.85 69.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.869 -0.419 . . . . 3.52 109.869 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.43 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 5.9 mmmm -56.83 -38.3 72.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.855 -0.611 . . . . 3.03 110.914 176.23 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.441 ' O ' HD21 ' A' ' 43' ' ' LEU . . . -71.42 -38.85 71.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.89 110.869 177.502 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.793 ' HA ' HD22 ' A' ' 43' ' ' LEU . 22.3 mt -71.42 -33.26 49.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.45 -0.341 . . . . 1.78 111.308 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.46 -33.76 74.3 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.995 0.426 . . . . 2.1 110.179 173.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.823 HD21 ' HB3' ' A' ' 73' ' ' LEU . 79.0 mt -62.73 -36.7 83.84 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.914 -0.585 . . . . 1.09 110.47 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.793 HD22 ' HA ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -57.47 -32.73 67.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.575 0.226 . . . . 2.0 111.036 178.222 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 78.7 mmm -71.41 -39.52 71.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.993 0.425 . . . . 2.68 110.544 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.88 -24.46 62.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.129 -0.487 . . . . 1.83 111.886 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.59 HG23 HD13 ' A' ' 73' ' ' LEU . 43.1 p -54.47 -42.36 70.6 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.55 -0.46 . . . . 1.5 109.877 175.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.25 -39.99 76.72 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.107 -0.497 . . . . 1.4 111.032 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.86 -46.91 85.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.629 -0.714 . . . . 2.51 110.655 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 47.5 t -76.4 -32.08 21.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.339 -0.392 . . . . 0.76 111.263 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.873 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 22.2 mt-10 -67.35 -38.94 85.63 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.913 0.338 . . . . 1.96 111.913 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.07 -19.05 62.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.852 0.358 . . . . 2.48 111.224 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -106.31 -25.06 12.1 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.286 -0.415 . . . . 2.4 112.088 -176.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.86 50.21 9.23 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 116.007 -0.542 . . . . 1.65 113.6 174.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -109.7 118.43 5.13 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.123 -1.036 . . . . 1.25 114.606 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.738 ' HB3' ' HA ' ' A' ' 64' ' ' ARG . 46.6 tp -177.97 131.63 0.15 Allowed 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.471 0.545 . . . . 2.02 112.471 168.26 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -124.65 101.52 7.16 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.107 -1.071 . . . . 3.65 108.107 165.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.741 HD11 " O2'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -68.85 -167.23 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 113.595 0.961 . . . . 1.28 113.595 -169.422 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.688 ' HE2' " O5'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -41.58 -48.01 3.94 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.534 -1.212 . . . . 1.44 111.52 177.902 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.539 HD21 ' N ' ' A' ' 61' ' ' SER . 4.2 t30 -116.02 -37.01 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.41 . . . . 2.28 111.008 173.082 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 98.69 8.02 54.91 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.23 -0.986 . . . . 1.21 111.354 -171.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.539 ' N ' HD21 ' A' ' 59' ' ' ASN . 5.3 p -54.66 -53.7 51.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.319 0.58 . . . . 2.35 110.867 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.531 ' O ' HD12 ' A' ' 57' ' ' ILE . 5.0 ptp180 -112.12 53.58 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.6 -0.889 . . . . 3.36 108.6 171.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . 0.452 ' HA ' ' CG1' ' A' ' 57' ' ' ILE . 14.9 ptp180 -50.36 132.42 24.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.786 -1.097 . . . . 4.14 112.211 -168.79 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.873 ' NH2' ' HA ' ' A' ' 50' ' ' GLU . 19.3 tpt85 68.26 44.82 1.32 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.992 0.901 . . . . 2.6 111.251 174.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.673 HG21 ' HA2' ' A' ' 68' ' ' GLY . 4.7 t -74.14 144.01 81.25 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.891 -1.049 . . . . 1.26 110.176 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -46.27 -59.54 1.18 Allowed 'Trans proline' 0 N--CA 1.485 1.016 0 C-N-CA 124.365 3.377 . . . . 0.51 113.883 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.953 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -66.97 -35.3 89.25 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.267 -0.968 . . . . 0.29 111.115 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.673 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -58.33 -32.61 68.37 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.821 -0.689 . . . . 0.32 112.227 176.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.47 ' O ' ' HB3' ' A' ' 72' ' ' ASN . 17.1 t -63.71 -35.04 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 CA-C-O 121.223 0.535 . . . . 0.74 110.561 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.6 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 14.5 t80 -65.29 -35.6 81.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.887 -0.597 . . . . 0.31 109.813 174.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.837 ' HB2' " H5'" ' P' ' 600' ' ' ' A' . 0.3 OUTLIER -60.21 -34.8 74.15 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.961 -1.125 . . . . 1.14 107.961 177.228 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.685 ' HB2' HD12 ' A' ' 55' ' ' LEU . 54.1 t30 -63.08 -27.13 69.18 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.326 -0.852 . . . . 1.14 110.072 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.823 ' HB3' HD21 ' A' ' 42' ' ' LEU . 67.7 mt -61.05 -33.4 73.24 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.834 -0.621 . . . . 1.07 111.253 175.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.721 ' HB3' HD13 ' A' ' 85' ' ' ILE . 8.4 mp -63.98 -20.38 65.85 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.143 -0.48 . . . . 1.73 109.983 175.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.664 ' HD3' ' C4 ' ' P' ' 600' ' ' ' A' . 0.0 OUTLIER -85.11 -45.26 12.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.363 0.602 . . . . 2.47 109.837 172.046 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -81.58 9.11 8.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.133 -0.94 . . . . 2.68 111.379 -176.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.612 ' CG2' ' HB ' ' A' ' 80' ' ' ILE . 9.9 t -68.47 122.47 84.64 Favored Pre-proline 0 N--CA 1.446 -0.668 0 N-CA-C 108.899 -0.778 . . . . 1.46 108.899 176.111 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 21.1 Cg_exo -65.87 -39.33 20.12 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.839 2.36 . . . . 1.2 113.629 -164.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 19.5 m -113.23 5.66 17.07 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.298 0.851 . . . . 1.84 113.298 -175.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.612 ' HB ' ' CG2' ' A' ' 77' ' ' THR . 62.7 mt -113.24 138.94 41.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 121.862 -0.524 . . . . 1.93 111.283 -174.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.2 p -97.12 155.15 16.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.436 0.636 . . . . 2.06 111.656 -177.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.477 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 57.3 mm-40 -59.37 -27.03 65.59 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.076 1.139 . . . . 2.89 114.076 -171.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.85 -43.92 86.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.676 0.671 . . . . 2.06 110.916 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 75.6 mm-40 -67.36 -26.52 66.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.79 0.805 . . . . 2.93 109.157 177.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.721 HD13 ' HB3' ' A' ' 74' ' ' LEU . 51.1 mm -75.9 -38.92 37.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.464 -1.244 . . . . 2.15 112.113 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.477 ' HG3' ' O ' ' A' ' 82' ' ' GLU . 8.0 mttm -57.7 -43.29 85.07 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 108.71 -0.848 . . . . 2.96 108.71 177.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -59.32 -32.89 70.49 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.885 -1.507 . . . . 1.7 109.862 -175.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 49.1 mt -71.94 -64.94 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.995 -1.002 . . . . 1.21 112.22 178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.722 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -108.32 -19.05 13.6 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 114.77 1.396 . . . . 1.16 114.77 -167.368 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.722 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 89.3 t80 -76.88 -34.11 57.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.396 0.543 . . . . 1.66 110.454 -174.133 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.6 mt -69.19 -20.94 24.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.054 -0.521 . . . . 1.23 110.325 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 54.84 -92.59 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.358 -0.837 . . . . 2.67 111.305 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -142.94 36.0 1.39 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.608 0.718 . . . . 4.89 109.912 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -91.23 23.38 3.34 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.677 -0.692 . . . . 3.67 110.154 172.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . 0.401 ' HE3' ' HB3' ' A' ' 95' ' ' LYS . 16.4 ttpp -81.37 65.84 6.67 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.624 -0.716 . . . . 8.45 110.596 -177.739 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -90.47 -50.98 5.64 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.038 -0.528 . . . . 7.63 110.0 177.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -87.97 151.7 22.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.947 -0.569 . . . . 9.25 110.687 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -83.98 99.41 10.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.932 -0.576 . . . . 10.06 110.31 -177.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -88.51 -14.44 37.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.947 -0.57 . . . . 12.32 111.191 -174.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -68.53 124.48 23.7 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.373 -0.376 . . . . 14.08 110.322 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . 0.451 ' H ' ' HD2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -78.22 98.13 5.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.044 -0.525 . . . . 15.92 111.552 -172.428 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -82.15 64.49 6.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.167 -0.47 . . . . 17.13 110.081 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -138.9 30.52 2.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.711 -0.677 . . . . 18.08 110.218 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 . . . . . 0 C--O 1.247 0.933 0 CA-C-N 115.299 -0.864 . . . . 19.89 110.128 -178.076 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' P' P ' 600' ' ' ' A' . . . . . 0.837 " H5'" ' HB2' ' A' ' 71' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 99.892 -2.808 OUTLIER-DELTA 0.0 '__' . 2.98 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 601' ' ' ' U' . . . . . 0.741 " O2'" HD11 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.513 -1.129 1 C4'-C3'-C2' 97.83 -4.87 OUTLIER-EPSILON 0.0 OUTLIER gamma 0.86 . . . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' P' P ' 602' ' ' ' C' . . . . . 0.488 ' OP1' " H1'" ' P' ' 601' ' ' ' U' . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 P-O3'-C3' 124.432 3.943 . 0.0 OUTLIER epsilon-1 7.67 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' P' P ' 603' ' ' ' G' . . . . . 0.701 " H3'" ' N3 ' ' P' ' 603' ' ' ' G' . . . . . . . . 0 O5'--C5' 1.426 -0.857 0 C4'-C3'-C2' 104.468 1.768 . 0.0 OUTLIER . 7.9 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 112.029 -0.428 . . . . 9.67 112.029 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.37 21.62 16.33 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.829 -0.218 . . . . 8.13 111.33 -175.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 65.8 mtt 59.34 43.33 16.81 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.144 -0.48 . . . . 7.59 111.325 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 64.27 36.5 9.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.578 -0.737 . . . . 4.97 112.072 175.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -96.18 12.67 29.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.467 0.651 . . . . 4.1 110.296 173.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -78.97 66.51 4.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.278 -0.874 . . . . 1.79 109.303 173.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -73.94 139.6 45.01 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.783 -0.821 . . . . 1.67 108.783 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.6 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 61.2 mt-30 -48.54 -45.77 37.9 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.974 0.731 . . . . 2.09 112.974 -169.173 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -63.67 -42.76 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 2.17 110.706 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -70.39 -37.13 74.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.04 0.448 . . . . 3.07 110.044 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.595 ' CG1' HD12 ' A' ' 15' ' ' ILE . 49.3 t -56.66 -51.91 60.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.634 -0.712 . . . . 0.39 110.865 177.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.18 -33.94 59.31 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.156 0.503 . . . . 1.1 111.206 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -70.38 -41.66 72.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.824 -0.625 . . . . 0.86 110.789 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -72.89 -42.63 63.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.372 -0.376 . . . . 2.05 111.597 -175.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.841 HD13 HD22 ' A' ' 43' ' ' LEU . 1.3 mm -58.68 -48.04 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 120.34 -0.544 . . . . 1.05 110.209 -177.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . 0.619 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 21.7 p -64.57 -34.61 78.67 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.667 -0.697 . . . . 0.39 110.899 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -68.49 -44.06 75.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.196 -0.457 . . . . 0.7 110.481 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -69.46 -46.28 67.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.906 -0.588 . . . . 3.55 111.72 -176.629 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.85 HD11 ' HA3' ' A' ' 67' ' ' GLY . 4.2 mm? -85.1 1.43 47.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.087 0.402 . . . . 1.66 112.087 -175.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 55.68 33.17 20.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.241 0.543 . . . . 2.19 109.561 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.693 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.08 116.77 18.77 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 114.623 -1.171 . . . . 1.67 112.694 -168.031 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.456 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 52.5 Cg_endo -63.45 -40.26 32.15 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 124.011 3.141 . . . . 0.41 113.33 172.326 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.558 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 41.9 pttt -109.0 68.56 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.824 0.821 . . . . 2.03 109.463 -172.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -62.77 -12.56 24.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.68 -1.146 . . . . 2.27 113.542 -166.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -75.42 -33.85 60.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.117 0.484 . . . . 2.14 110.115 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.628 HD13 ' HA ' ' A' ' 89' ' ' PHE . 0.6 OUTLIER -73.57 -47.33 41.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 2.02 110.171 -178.548 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.693 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 11.0 tp -62.97 -29.43 47.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.216 -0.447 . . . . 1.18 110.895 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.664 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.94 -33.42 63.91 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.061 0.457 . . . . 1.03 110.673 174.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.441 ' CD ' ' HA ' ' A' ' 88' ' ' ILE . 14.0 ttm180 -58.15 -40.15 80.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.032 -0.531 . . . . 1.96 110.874 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 23.3 t -53.06 -44.7 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.487 0.66 . . . . 1.15 109.535 177.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.664 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 82.0 t -52.95 -50.37 44.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 114.19 -1.368 . . . . 0.22 111.149 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -66.07 -41.92 90.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.298 -0.865 . . . . 4.21 111.14 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 50.1 mm -74.67 -50.27 26.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.897 -0.592 . . . . 1.5 112.541 -172.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 33.1 pt -95.56 -29.49 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.106 -0.638 . . . . 1.12 111.902 -174.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.33 160.81 10.98 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.401 -0.904 . . . . 0.28 112.651 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.6 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 3.0 p-10 -67.84 -48.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.49 0.186 . . . . 0.99 111.409 -177.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.404 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 19.4 ptmt -71.73 -33.09 68.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.067 0.461 . . . . 3.52 109.876 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -64.31 -32.2 73.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.016 -0.538 . . . . 3.03 109.844 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.24 -42.52 75.53 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.869 -0.605 . . . . 0.89 109.991 173.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.751 ' HA ' ' HG ' ' A' ' 43' ' ' LEU . 44.8 mm -59.96 -37.68 73.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 120.921 0.391 . . . . 1.78 110.672 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.406 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 14.4 mm-40 -54.33 -46.45 72.9 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.236 -0.653 . . . . 2.1 109.236 173.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.929 HD23 ' HB3' ' A' ' 73' ' ' LEU . 72.2 mt -65.63 -43.18 90.29 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.268 -0.878 . . . . 1.09 111.279 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.841 HD22 HD13 ' A' ' 15' ' ' ILE . 4.8 mt -56.68 -38.74 72.65 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.024 0.44 . . . . 2.0 110.334 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 tpp -74.69 -39.78 61.77 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.215 -0.448 . . . . 2.68 109.926 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 40.6 mt-10 -70.01 -23.69 63.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.721 -0.672 . . . . 1.83 112.172 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.533 ' O ' ' HG3' ' A' ' 50' ' ' GLU . 71.6 p -51.1 -49.11 61.35 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.715 0.293 . . . . 1.5 110.25 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.62 82.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.724 -0.671 . . . . 1.4 111.481 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.402 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 36.6 mt-10 -66.94 -40.22 87.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.153 0.502 . . . . 2.51 110.389 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -76.85 -33.51 21.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.065 -0.516 . . . . 0.76 110.495 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.533 ' HG3' ' O ' ' A' ' 46' ' ' THR . 40.5 mt-10 -58.44 -51.47 69.71 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.344 -0.389 . . . . 1.96 111.27 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 5.3 pp0? -63.72 -22.76 67.07 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 123.371 0.419 . . . . 2.48 111.085 -176.208 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -89.47 -12.65 39.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.341 0.591 . . . . 2.4 110.394 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.45 28.93 64.75 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.673 -0.694 . . . . 1.65 112.488 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.408 ' O ' ' HB2' ' A' ' 55' ' ' LEU . . . -89.48 101.27 2.75 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.678 -0.772 . . . . 1.25 113.889 -174.018 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.817 HD21 ' HB2' ' A' ' 72' ' ' ASN . 2.7 tm? -176.62 124.57 0.17 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.102 0.477 . . . . 2.02 111.268 170.093 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -124.6 105.03 9.04 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.24 -1.022 . . . . 3.65 108.24 164.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.682 ' CG2' HD12 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -77.5 -179.45 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 112.583 0.586 . . . . 1.28 112.583 -171.02 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 1.019 ' HE1' " H4'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -52.47 -43.93 65.28 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.778 -0.646 . . . . 1.44 111.481 -176.799 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -90.49 -37.54 13.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 2.28 110.989 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 83.75 -14.87 39.83 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.163 -0.541 . . . . 1.21 112.703 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -57.78 11.51 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.892 0.377 . . . . 2.35 111.253 -176.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.466 ' O ' HD12 ' A' ' 57' ' ' ILE . 7.8 ptp180 -96.41 55.69 1.5 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.536 0.684 . . . . 3.36 109.605 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.5 ptt180 -53.89 146.36 14.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.127 -0.942 . . . . 4.14 111.795 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.557 ' H ' HD13 ' A' ' 55' ' ' LEU . 0.0 OUTLIER 61.95 49.83 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.629 -1.169 . . . . 2.6 112.621 -177.815 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.857 HG21 ' HA2' ' A' ' 68' ' ' GLY . 1.8 t -75.51 142.01 73.78 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.256 -0.883 . . . . 1.26 109.457 169.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -47.31 -59.12 1.37 Allowed 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 123.831 3.021 . . . . 0.51 112.808 -175.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.85 ' HA3' HD11 ' A' ' 19' ' ' LEU . . . -62.65 -39.19 97.59 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.018 -0.833 . . . . 0.29 111.018 177.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.857 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.79 -31.97 61.44 Favored Glycine 0 N--CA 1.447 -0.579 0 CA-C-N 114.866 -0.667 . . . . 0.32 112.868 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 11.0 t -66.13 -38.33 81.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.124 0.487 . . . . 0.74 109.891 179.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.514 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 5.9 t80 -66.41 -38.69 88.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.162 -0.472 . . . . 0.31 109.932 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.693 HD21 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -57.0 -34.52 68.23 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.83 -0.804 . . . . 1.14 108.83 176.19 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.817 ' HB2' HD21 ' A' ' 55' ' ' LEU . 6.0 t30 -59.59 -38.94 82.56 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.559 -0.746 . . . . 1.14 110.154 176.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.929 ' HB3' HD23 ' A' ' 42' ' ' LEU . 70.9 mt -58.35 -35.06 71.37 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.55 -0.75 . . . . 1.07 112.084 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.536 HD13 ' HA ' ' A' ' 71' ' ' LEU . 14.7 mt -57.54 -47.02 83.14 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.326 -0.397 . . . . 1.73 110.961 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.649 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.1 OUTLIER -93.03 -7.75 44.86 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.142 -0.623 . . . . 2.47 111.808 -179.091 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -98.82 -18.0 18.17 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.221 -0.445 . . . . 2.68 111.013 -178.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.516 HG22 HD13 ' A' ' 80' ' ' ILE . 10.1 t -58.6 126.22 78.93 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.698 0.761 . . . . 1.46 110.973 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.2 Cg_exo -73.91 -25.75 13.93 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 123.31 2.674 . . . . 1.2 113.282 -171.219 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.0 t -101.35 -2.54 30.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.175 0.435 . . . . 1.84 112.175 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.516 HD13 HG22 ' A' ' 77' ' ' THR . 36.2 mt -119.29 136.87 55.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 121.931 -0.481 . . . . 1.93 110.911 -176.524 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -85.25 153.87 22.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.182 0.515 . . . . 2.06 110.578 -176.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.86 -30.35 71.45 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.306 -0.861 . . . . 2.89 112.942 -167.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.41 -36.88 79.74 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.94 -0.304 . . . . 2.06 111.437 -176.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -66.2 -36.08 82.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.61 0.719 . . . . 2.93 109.536 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 45.8 mm -74.97 -36.62 39.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.878 -1.056 . . . . 2.15 111.629 -177.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.524 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 23.0 ttmm -51.55 -39.22 57.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 2.96 111.49 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -71.41 -33.1 69.14 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.053 -0.521 . . . . 1.7 111.498 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.441 ' HA ' ' CD ' ' A' ' 29' ' ' ARG . 57.7 mt -65.96 -67.7 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 112.569 0.581 . . . . 1.21 112.569 -170.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.749 ' H ' ' HD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -112.05 -27.56 8.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.466 0.543 . . . . 1.16 112.466 -170.596 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.524 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.7 t80 -67.35 -36.35 81.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.109 0.481 . . . . 1.66 111.233 -172.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.6 mt -65.16 -45.31 94.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 1.23 110.279 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 58.39 -92.24 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.457 -0.792 . . . . 2.67 111.798 175.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.2 p-10 -124.12 7.18 8.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.825 0.345 . . . . 4.89 110.802 -176.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -66.0 110.73 3.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.993 -0.548 . . . . 3.67 111.139 -176.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -125.13 157.38 36.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.999 -0.546 . . . . 8.45 109.834 177.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.812 ' HA ' ' HE2' ' A' ' 96' ' ' GLU . 10.6 mm-40 -127.31 -32.93 2.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.253 -0.431 . . . . 7.63 111.131 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -91.07 36.92 0.92 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.957 0.408 . . . . 9.25 110.84 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -97.14 134.69 40.14 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.65 -0.5 . . . . 10.06 109.65 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -156.61 150.41 24.82 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.163 -0.471 . . . . 12.32 110.858 -177.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -177.1 -41.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.605 -0.725 . . . . 14.08 109.701 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -160.38 98.24 1.26 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.022 -0.535 . . . . 15.92 109.783 173.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.94 30.29 19.53 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.617 -0.719 . . . . 17.13 111.214 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.27 27.77 12.29 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.863 -0.608 . . . . 18.08 110.827 -175.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 . . . . . 0 C--O 1.253 1.279 0 CA-C-O 118.582 -0.723 . . . . 19.89 109.829 -177.324 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' P' P ' 600' ' ' ' A' . . . . . 0.594 " O5'" ' HB2' ' A' ' 71' ' ' LEU . . . . . . . . 0 O5'--C5' 1.422 -1.099 0 C4'-C3'-C2' 100.03 -2.67 . 0.0 '__' . 2.98 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' P' P ' 601' ' ' ' U' . . . . . 1.019 " H4'" ' HE1' ' A' ' 58' ' ' MET . . . . . . . . 0 C2'--C1' 1.538 0.974 1 C4'-C3'-C2' 97.033 -5.667 OUTLIER-EPSILON 0.0 OUTLIER alpha 0.86 . . . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' P' P ' 602' ' ' ' C' . . . . . 0.456 ' P ' ' HE2' ' A' ' 58' ' ' MET . . . . . . . . 0 O5'--C5' 1.424 -0.98 1 P-O3'-C3' 125.668 4.974 . 0.0 OUTLIER epsilon-1 7.67 . . . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' P' P ' 603' ' ' ' G' . . . . . 0.429 " H3'" " H5'" ' P' ' 602' ' ' ' C' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 O4'-C1'-N19 109.794 1.594 . 0.0 OUTLIER . 7.9 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.559 0 N-CA-C 111.863 -0.495 . . . . 9.67 111.863 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.05 105.54 1.38 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.946 0.403 . . . . 8.13 110.302 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 54.3 mtm -81.99 68.6 8.44 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.909 -0.587 . . . . 7.59 111.049 -175.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.4 -51.14 5.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.259 -0.428 . . . . 4.97 110.597 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 57.89 40.02 26.24 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 122.033 0.921 . . . . 4.1 109.843 -177.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 -94.68 67.63 3.3 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.409 -1.269 . . . . 1.79 110.41 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.8 m -64.94 130.92 45.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.596 -0.729 . . . . 1.67 110.289 177.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.743 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.7 mt-30 -51.43 -47.05 63.13 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.905 0.705 . . . . 2.09 112.905 -167.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.61 -46.7 87.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.407 0.146 . . . . 2.17 110.956 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -58.72 -41.63 86.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.035 0.445 . . . . 3.07 109.962 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.491 ' CG1' HD12 ' A' ' 15' ' ' ILE . 78.3 t -60.03 -57.74 10.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.499 -0.773 . . . . 0.39 110.772 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.13 -38.23 70.54 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.291 0.567 . . . . 1.1 111.276 -176.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -39.29 89.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.434 -0.803 . . . . 0.86 110.665 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -76.71 -38.31 54.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.119 -0.491 . . . . 2.05 112.038 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.491 HD12 ' CG1' ' A' ' 11' ' ' VAL . 2.2 mm -61.28 -47.34 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 C-N-CA 120.376 -0.529 . . . . 1.05 110.036 -177.448 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 17.0 p -58.25 -38.51 77.04 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.944 -0.571 . . . . 0.39 110.791 -179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -68.69 -45.16 72.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 0.7 110.835 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -67.01 -43.38 83.02 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.238 0.458 . . . . 3.55 112.238 -175.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.552 HD11 ' O ' ' A' ' 66' ' ' PRO . 3.6 mm? -79.41 -9.8 59.67 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.566 -0.454 . . . . 1.66 111.249 178.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 53.59 31.23 12.15 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.531 -0.914 . . . . 2.19 108.531 -170.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.593 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 19.6 tt0 -69.34 130.13 91.18 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 114.124 -1.398 . . . . 1.67 112.073 -169.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.525 ' HD2' ' O4 ' ' P' ' 601' ' ' ' U' . 43.4 Cg_endo -64.41 -54.84 0.69 Allowed 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 124.352 3.368 . . . . 0.41 113.238 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.496 ' HZ1' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -85.61 67.89 10.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.918 0.866 . . . . 2.03 110.657 -176.848 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 77.1 mttt -62.9 -19.69 64.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.518 -1.219 . . . . 2.27 112.143 -172.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.39 -41.62 85.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.195 0.521 . . . . 2.14 110.119 174.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.746 HD22 ' HA ' ' A' ' 89' ' ' PHE . 1.6 tm? -73.1 -42.93 62.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.431 -0.804 . . . . 2.02 110.811 -176.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ILE . . . . . 0.593 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 5.1 tp -61.32 -32.17 52.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.916 0.388 . . . . 1.18 110.375 -177.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ALA . . . . . 0.568 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.25 -35.15 61.44 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.235 -0.439 . . . . 1.03 110.881 174.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.2 ttm-85 -62.31 -41.12 98.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.34 -0.391 . . . . 1.96 111.21 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 28.8 t -53.83 -45.25 62.3 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.192 0 CA-C-O 121.307 0.575 . . . . 1.15 109.595 178.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.568 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.5 t -53.21 -51.69 37.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 114.503 -1.226 . . . . 0.22 110.748 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -59.67 -42.64 93.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 4.21 111.709 -177.108 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 45.1 mm -74.99 -53.03 17.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 112.882 0.697 . . . . 1.5 112.882 -173.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ILE . . . . . 0.527 HD13 ' HB3' ' A' ' 38' ' ' LYS . 29.8 pt -95.71 -7.63 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 112.192 0.441 . . . . 1.12 112.192 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.07 161.91 26.56 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.345 -0.931 . . . . 0.28 112.392 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . 0.743 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 13.8 p-10 -63.84 -42.31 97.63 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 122.377 0.271 . . . . 0.99 111.601 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.416 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 39.5 ttpt -67.33 -50.42 60.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.051 -0.26 . . . . 3.52 111.019 -175.396 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' LYS . . . . . 0.527 ' HB3' HD13 ' A' ' 34' ' ' ILE . 12.2 mmmt -61.47 -26.43 67.88 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.66 0.244 . . . . 3.03 111.66 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.471 ' O ' HD21 ' A' ' 43' ' ' LEU . . . -67.36 -47.66 69.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.01 -0.367 . . . . 0.89 110.01 176.07 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ILE . . . . . 0.649 ' HA ' HD22 ' A' ' 43' ' ' LEU . 49.4 mm -66.35 -38.15 81.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 120.986 0.422 . . . . 1.78 110.219 177.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 32.9 mm-40 -55.9 -38.89 70.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.814 -0.63 . . . . 2.1 110.051 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.686 ' HB3' HD11 ' A' ' 73' ' ' LEU . 22.0 mt -62.88 -43.42 98.85 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.161 -0.472 . . . . 1.09 112.093 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.649 HD22 ' HA ' ' A' ' 40' ' ' ILE . 0.1 OUTLIER -64.19 -28.58 69.84 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 119.579 -0.849 . . . . 2.0 111.094 178.895 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.2 mtp -73.9 -36.89 64.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.142 0.496 . . . . 2.68 110.002 170.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . 0.489 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.3 mt-10 -65.77 -25.54 67.31 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.659 -0.7 . . . . 1.83 111.706 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.626 HG21 HD12 ' A' ' 73' ' ' LEU . 68.5 p -55.35 -40.0 70.72 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.868 0.366 . . . . 1.5 110.116 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.92 -32.86 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 1.4 110.859 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.45 ' HA ' ' HG3' ' A' ' 51' ' ' GLN . 29.1 mt-10 -71.41 -27.99 63.68 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.101 -0.5 . . . . 2.51 109.93 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 56.7 t -69.23 -43.25 81.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.118 0.485 . . . . 0.76 109.767 170.311 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.587 ' HG2' ' O ' ' A' ' 46' ' ' THR . 4.6 mm-40 -55.83 -42.99 76.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.42 -0.809 . . . . 1.96 110.44 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.45 ' HG3' ' HA ' ' A' ' 48' ' ' GLU . 5.3 pp0? -82.55 -19.02 39.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.106 -0.497 . . . . 2.48 111.686 -176.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -87.87 -26.7 22.63 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.271 0.471 . . . . 2.4 112.271 -171.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.95 -12.54 2.37 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 119.967 -1.111 . . . . 1.65 113.29 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.33 -133.18 10.95 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.093 -1.051 . . . . 1.25 114.81 171.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.717 ' N ' ' HD3' ' A' ' 64' ' ' ARG . 0.6 OUTLIER -162.83 131.94 4.16 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.599 0.36 . . . . 2.02 110.895 -163.467 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PHE . . . . . 0.627 ' N ' HD21 ' A' ' 55' ' ' LEU . 34.6 t80 -116.74 110.55 18.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.269 -1.012 . . . . 3.65 108.269 168.716 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.835 HD11 " O2'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -77.73 -178.41 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.375 0.88 . . . . 1.28 113.375 -170.444 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.965 ' HE1' " H4'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -50.92 -46.53 60.84 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 115.801 -0.636 . . . . 1.44 111.345 -177.206 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.568 HD22 ' HB3' ' A' ' 61' ' ' SER . 0.9 OUTLIER -92.8 -36.74 12.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.081 -0.509 . . . . 2.28 110.212 176.423 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.22 -19.69 16.81 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 114.598 0.599 . . . . 1.21 114.598 169.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.568 ' HB3' HD22 ' A' ' 59' ' ' ASN . 8.4 t -66.7 -45.61 78.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 117.377 0.589 . . . . 2.35 110.412 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.422 ' HG2' ' O ' ' A' ' 62' ' ' ARG . 20.0 ttt180 -85.48 42.09 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.699 0.761 . . . . 3.36 109.687 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -46.95 132.04 11.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.477 -1.238 . . . . 4.14 113.076 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.717 ' HD3' ' N ' ' A' ' 55' ' ' LEU . 19.2 mmm180 68.42 57.97 0.44 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.754 -1.112 . . . . 2.6 112.238 175.142 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' THR . . . . . 0.762 HG21 ' HA2' ' A' ' 68' ' ' GLY . 5.3 t -82.73 144.69 49.02 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 114.779 -1.1 . . . . 1.26 108.19 169.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . 0.552 ' O ' HD11 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.45 -60.35 0.9 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 123.825 3.017 . . . . 0.51 113.746 -173.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.715 ' HA2' ' O4 ' ' P' ' 601' ' ' ' U' . . . -65.25 -37.22 93.74 Favored Glycine 0 C--O 1.224 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.29 111.163 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.762 ' HA2' HG21 ' A' ' 65' ' ' THR . . . -56.37 -32.88 61.07 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.123 -0.539 . . . . 0.32 112.705 178.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 48.3 t -62.6 -40.69 89.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.226 0.536 . . . . 0.74 109.729 176.318 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . 0.545 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 12.5 t80 -65.24 -36.99 85.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.53 -0.759 . . . . 0.31 109.993 174.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.727 ' HB2' " O5'" ' P' ' 600' ' ' ' A' . 0.1 OUTLIER -57.54 -43.53 84.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.177 -1.046 . . . . 1.14 108.177 177.779 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ASN . . . . . 0.553 ' HB2' HD22 ' A' ' 55' ' ' LEU . 60.4 t30 -55.93 -26.42 47.72 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.73 0.643 . . . . 1.14 110.924 -178.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.686 HD11 ' HB3' ' A' ' 42' ' ' LEU . 77.0 mt -56.39 -41.59 76.54 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.024 -0.535 . . . . 1.07 111.297 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.626 ' O ' HD12 ' A' ' 85' ' ' ILE . 6.5 mp -62.47 -19.02 63.12 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.014 0.435 . . . . 1.73 110.784 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LYS . . . . . 0.423 ' HZ1' ' HB2' ' A' ' 74' ' ' LEU . 1.1 mppt? -91.62 -23.37 19.88 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.729 0.27 . . . . 2.47 111.729 178.607 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -114.64 -11.99 12.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.675 0.274 . . . . 2.68 111.446 -173.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.745 HG22 HD13 ' A' ' 80' ' ' ILE . 5.5 t -60.24 132.75 90.35 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 121.661 0.743 . . . . 1.46 111.281 -172.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 3.4 Cg_exo -74.3 -36.97 2.8 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 123.536 2.824 . . . . 1.2 114.676 -167.246 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 39.6 m -111.88 17.59 19.62 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.135 1.161 . . . . 1.84 114.135 -168.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.745 HD13 HG22 ' A' ' 77' ' ' THR . 44.0 mt -115.2 134.03 59.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 118.289 0.495 . . . . 1.93 110.523 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 41.2 m -75.9 143.98 41.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.651 0.739 . . . . 2.06 111.562 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -52.58 -45.38 66.44 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.061 -1.427 . . . . 2.89 113.632 -168.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.82 -42.12 77.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.944 -0.302 . . . . 2.06 110.919 -177.826 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.32 -31.71 69.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.46 0.647 . . . . 2.93 110.001 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ILE . . . . . 0.626 HD12 ' O ' ' A' ' 74' ' ' LEU . 97.3 mt -66.86 -45.85 86.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.776 -1.102 . . . . 2.15 111.404 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.435 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 14.0 ttmm -56.27 -39.52 72.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.889 -0.596 . . . . 2.96 111.083 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -66.65 -31.69 72.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.562 -0.745 . . . . 1.7 112.622 -173.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 43.3 mt -69.87 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.359 0.503 . . . . 1.21 112.359 -173.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.746 ' HA ' HD22 ' A' ' 26' ' ' LEU . 9.9 p90 -95.59 -20.98 18.54 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.634 0.605 . . . . 1.16 112.634 -164.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' TYR . . . . . 0.435 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 90.7 t80 -93.77 -10.38 34.37 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.298 -0.41 . . . . 1.66 111.865 -165.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt -91.88 -71.88 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.686 -0.405 . . . . 1.23 111.768 -176.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 45.37 -97.72 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.877 0.695 . . . . 2.67 112.877 -174.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -79.49 -37.01 37.73 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.875 0.324 . . . . 4.89 111.875 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -81.67 73.76 8.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.348 0.594 . . . . 3.67 110.342 -176.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -76.18 -65.45 0.92 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.365 -0.834 . . . . 8.45 110.828 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -168.64 85.96 0.18 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.828 -0.623 . . . . 7.63 109.939 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 40.2 m-85 -89.63 43.07 1.12 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 9.25 110.989 -178.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -81.39 58.97 3.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.236 0.541 . . . . 10.06 110.341 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASN . . . . . 0.476 ' HB2' ' NH1' ' A' ' 104' ' ' ARG . 0.1 OUTLIER -87.68 164.19 16.14 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.688 -0.687 . . . . 12.32 110.094 179.0 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 100' ' ' LYS . 21.1 ptmt -96.92 144.93 26.37 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.74 -0.467 . . . . 14.08 109.74 176.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -113.15 77.58 1.06 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.131 0.491 . . . . 15.92 110.591 -175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.98 -78.53 0.54 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.867 -0.606 . . . . 17.13 110.107 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -97.95 60.0 1.45 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.254 0.55 . . . . 18.08 110.147 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ARG . . . . . 0.476 ' NH1' ' HB2' ' A' ' 99' ' ' ASN . 41.3 ttm180 . . . . . 0 C--O 1.246 0.916 0 CA-C-N 115.485 -0.78 . . . . 19.89 110.061 -178.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 600' ' ' ' A' . . . . . 0.727 " O5'" ' HB2' ' A' ' 71' ' ' LEU . . . . . . . . 0 O5'--C5' 1.423 -1.086 0 C4'-C3'-C2' 101.179 -1.521 . 0.0 '__' . 2.98 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' P' P ' 601' ' ' ' U' . . . . . 0.965 " H4'" ' HE1' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.509 -1.435 1 C4'-C3'-C2' 96.395 -6.305 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 010 nuclear orig full ' P' P ' 602' ' ' ' C' . . . . . 0.552 " O5'" ' HB3' ' A' ' 59' ' ' ASN . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C4'-C3'-C2' 106.051 3.351 OUTLIER-DELTA 0.0 OUTLIER delta-1 7.67 . . . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' P' P ' 603' ' ' ' G' . . . . . 0.552 " H5'" ' N3 ' ' P' ' 603' ' ' ' G' . . . . . . . . 0 O5'--C5' 1.424 -1.015 0 O4'-C1'-C2' 107.403 0.717 . 0.0 OUTLIER . 7.9 . . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.776 ' HB3' HD12 ' A' ' 40' ' ' ILE . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.143 0 N-CA-C 112.571 0.582 . . . . 1.79 112.571 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.467 ' O ' HG23 ' A' ' 11' ' ' VAL . 28.5 t -74.93 121.8 22.46 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.141 -1.059 . . . . 1.33 108.141 170.048 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 36' ' ' ASN . 0.2 OUTLIER -56.64 -29.91 62.74 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.417 0.525 . . . . 1.88 112.417 -169.533 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.68 -47.96 70.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.907 0.384 . . . . 2.17 110.143 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -63.31 -40.49 97.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.887 -0.597 . . . . 2.55 110.25 175.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.657 ' O ' HG12 ' A' ' 15' ' ' ILE . 93.1 t -57.44 -54.56 29.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 0.39 110.606 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -40.09 75.86 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.954 0.407 . . . . 0.35 111.576 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.71 -32.83 73.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.944 -0.571 . . . . 0.86 110.519 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -71.8 -48.15 48.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.739 -0.664 . . . . 2.05 111.013 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 11' ' ' VAL . 1.2 mm -58.38 -50.89 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-O 121.277 0.561 . . . . 0.33 110.012 -178.18 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.557 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 12.7 p -59.08 -37.23 76.59 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.425 -0.807 . . . . 0.32 111.576 -175.092 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.71 -44.95 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.442 -0.344 . . . . 0.59 110.897 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.7 mtp85 -72.42 -29.47 63.74 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.507 0.558 . . . . 2.83 112.507 -173.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.633 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 3.8 mm? -93.97 0.04 55.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.758 0.313 . . . . 0.99 111.292 178.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 50.47 44.82 26.92 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 115.285 -0.871 . . . . 1.6 109.14 -173.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.842 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -61.26 120.15 52.37 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 114.523 -1.217 . . . . 1.31 112.427 -170.514 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 55.4 Cg_endo -64.46 -39.63 27.8 Favored 'Trans proline' 0 CA--C 1.529 0.273 0 C-N-CA 124.28 3.32 . . . . 0.41 113.084 174.101 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 pttt -120.45 63.8 0.84 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.195 0.522 . . . . 1.41 109.948 -172.063 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -56.25 -17.6 8.02 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.315 1.228 . . . . 1.75 114.315 -164.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.16 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 2.14 110.029 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.856 HD11 ' HB3' ' A' ' 89' ' ' PHE . 2.2 tm? -73.16 -51.57 17.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.573 -0.739 . . . . 1.33 110.387 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.842 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 7.3 tp -62.36 -32.29 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 116.231 -0.44 . . . . 0.44 111.03 -177.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.739 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -72.9 -33.0 65.74 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.56 0.695 . . . . 0.21 110.078 174.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.485 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 33.3 ttm180 -63.35 -40.92 98.61 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.23 -0.896 . . . . 1.48 111.908 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.67 ' HA ' HD13 ' A' ' 88' ' ' ILE . 33.0 t -53.19 -45.07 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 N-CA-C 108.781 -0.822 . . . . 1.1 108.781 177.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.739 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -53.02 -55.75 10.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.009 -1.45 . . . . 0.22 111.478 174.386 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -59.53 -40.14 86.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.608 -0.724 . . . . 3.75 111.304 -177.159 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.65 HG13 HG12 ' A' ' 88' ' ' ILE . 47.0 mm -75.3 -53.11 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.802 0.668 . . . . 0.8 112.802 -176.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.641 HG12 ' O ' ' A' ' 30' ' ' VAL . 28.3 pt -88.06 -29.28 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 C-N-CA 120.061 -0.656 . . . . 0.4 112.248 -171.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.54 156.2 8.54 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.33 -0.938 . . . . 0.26 112.644 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 8' ' ' GLN . 14.1 p-10 -62.25 -52.02 65.39 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.402 0.281 . . . . 0.91 111.568 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 84.8 tttt -71.74 -36.69 70.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 3.19 110.25 -179.277 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.424 ' HB2' HG13 ' A' ' 34' ' ' ILE . 11.1 mmmm -59.18 -29.76 67.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.701 -0.681 . . . . 2.45 111.269 -178.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.89 68.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.828 0.347 . . . . 0.29 110.676 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.776 HD12 ' HB3' ' A' ' 6' ' ' ASP . 37.1 mt -72.21 -34.19 48.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 120.911 0.386 . . . . 1.13 110.578 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 16.4 mm-40 -55.29 -39.62 70.08 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.219 -0.66 . . . . 2.1 109.219 172.877 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.814 HD22 ' HB3' ' A' ' 73' ' ' LEU . 66.8 mt -67.4 -35.51 79.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.346 -0.843 . . . . 0.29 111.101 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.627 HD21 HD13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -60.4 -37.23 80.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.906 0.384 . . . . 1.36 111.07 178.307 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.452 ' HE2' ' HA ' ' A' ' 41' ' ' GLU . 39.5 mtm -72.53 -36.49 68.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.265 0.555 . . . . 2.2 109.632 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -71.07 -28.36 64.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.538 -0.755 . . . . 1.83 111.317 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.86 HG23 HD11 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -61.0 -35.95 78.19 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 110.235 -0.283 . . . . 1.03 110.235 178.064 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -65.52 -35.07 79.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.048 0.452 . . . . 0.88 110.714 175.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.57 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 30.2 tt0 -68.31 -39.9 81.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.174 0.511 . . . . 2.51 109.657 178.008 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.4 t -69.11 -33.54 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.76 110.035 173.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.728 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 2.6 mm-40 -59.96 -44.06 94.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 1.96 111.233 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.57 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 1.9 pt20 -72.82 -19.73 61.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 2.25 111.245 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -100.09 -25.28 14.35 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.04 0.448 . . . . 2.34 111.766 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.21 41.67 25.81 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.963 -0.562 . . . . 1.33 113.228 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.87 128.99 9.41 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.55 -0.833 . . . . 0.89 113.922 -175.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 1.114 HD23 ' HB2' ' A' ' 72' ' ' ASN . 2.2 tm? -177.43 125.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.947 0.403 . . . . 1.38 110.43 170.198 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.53 ' N ' HD22 ' A' ' 55' ' ' LEU . 94.1 m-85 -124.26 108.69 12.51 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.498 -0.927 . . . . 2.87 108.498 165.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.847 HG23 HD11 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -82.84 -176.57 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.193 -0.458 . . . . 0.68 111.438 -178.277 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.81 -36.32 58.25 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.999 0.741 . . . . 0.91 112.999 -173.416 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.595 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 0.1 OUTLIER -88.71 -35.52 16.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.606 0.595 . . . . 2.28 112.606 -179.069 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.87 -19.86 10.89 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 121.64 -0.314 . . . . 1.21 112.492 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.595 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 57.8 m -71.13 -58.41 3.58 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.971 0.415 . . . . 2.18 110.145 177.06 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.417 ' CB ' HD11 ' A' ' 57' ' ' ILE . 99.8 mtt180 -67.96 138.1 55.67 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.655 -1.239 . . . . 2.89 107.655 167.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -142.63 126.01 16.65 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.421 -0.585 . . . . 3.59 109.421 -172.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.79 ' HD2' HG22 ' A' ' 69' ' ' VAL . 0.0 OUTLIER 62.51 56.07 2.12 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.476 -0.784 . . . . 1.98 112.194 -175.973 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.891 HG23 ' HA3' ' A' ' 68' ' ' GLY . 2.2 t -78.82 139.21 57.74 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 108.114 -1.069 . . . . 0.44 108.114 167.308 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.529 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.32 -59.76 1.1 Allowed 'Trans proline' 0 N--CA 1.48 0.685 0 C-N-CA 123.459 2.773 . . . . 0.44 112.978 -173.178 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.7 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -66.35 -38.86 94.0 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.407 -0.902 . . . . 0.25 111.245 177.3 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.891 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.68 -34.97 65.41 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.333 -0.433 . . . . 0.3 112.909 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.79 HG22 ' HD2' ' A' ' 64' ' ' ARG . 98.8 t -59.04 -42.78 87.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.106 0.479 . . . . 0.74 110.133 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.555 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 10.5 t80 -65.59 -37.01 85.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.825 -0.625 . . . . 0.26 109.975 174.014 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.7 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.39 -34.58 70.88 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.761 -0.829 . . . . 0.32 108.761 177.744 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 1.114 ' HB2' HD23 ' A' ' 55' ' ' LEU . 65.4 t30 -60.04 -30.61 69.3 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.656 -0.702 . . . . 1.08 110.186 177.814 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.86 HD11 HG23 ' A' ' 46' ' ' THR . 84.9 mt -58.62 -34.26 70.95 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.619 -0.719 . . . . 0.46 112.111 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.813 ' HB3' HG23 ' A' ' 85' ' ' ILE . 7.3 mp -65.73 -20.34 66.24 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.109 0.48 . . . . 1.08 110.795 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.624 ' HE2' ' HA ' ' A' ' 72' ' ' ASN . 8.9 mtmm -92.79 -34.35 13.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.281 0.562 . . . . 1.93 110.254 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -87.46 -13.11 44.1 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.154 -0.93 . . . . 2.12 110.877 -173.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.512 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 14.7 t -62.76 130.26 93.64 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.737 0.78 . . . . 0.94 110.751 -177.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 2.8 Cg_exo -74.86 -39.95 1.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.439 2.76 . . . . 1.0 113.725 -171.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.2 m -112.94 16.15 19.5 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.105 1.15 . . . . 1.49 114.105 -167.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.419 HD13 HG21 ' A' ' 34' ' ' ILE . 55.8 mt -112.6 137.69 44.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 118.683 0.674 . . . . 1.21 111.437 -177.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.4 m -74.04 141.44 45.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.523 -0.762 . . . . 1.79 111.042 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.15 -27.56 69.04 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.182 -0.917 . . . . 2.89 112.869 -174.449 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.84 -46.72 84.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 2.06 110.137 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.564 ' O ' HG13 ' A' ' 88' ' ' ILE . 77.9 mm-40 -60.68 -38.86 86.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 2.31 109.869 177.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.813 HG23 ' HB3' ' A' ' 74' ' ' LEU . 33.4 mm -60.03 -50.65 79.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.377 -0.829 . . . . 1.41 110.608 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.546 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 18.8 ttpt -60.06 -43.46 95.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.608 -0.724 . . . . 2.45 110.284 176.022 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -63.72 -34.31 77.58 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.411 -0.813 . . . . 1.7 111.715 -174.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.67 HD13 ' HA ' ' A' ' 30' ' ' VAL . 72.9 mt -70.29 -72.34 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.174 0.435 . . . . 0.42 112.174 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.856 ' HB3' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -106.48 -16.38 14.55 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.361 0.874 . . . . 0.75 113.361 -168.589 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.662 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 86.9 t80 -77.47 -24.75 50.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.355 0.598 . . . . 1.13 110.212 -173.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.561 -0.745 . . . . 0.86 109.721 174.051 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 109.693 -0.484 . . . . 1.79 109.693 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.437 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.2 m -58.33 124.34 19.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.66 -0.496 . . . . 1.33 109.66 176.116 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.474 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.9 mt-30 -57.21 -32.28 66.33 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.883 -0.599 . . . . 1.88 112.155 -169.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.92 -42.1 73.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.065 0.46 . . . . 2.17 110.291 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -71.03 -38.87 72.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.815 -0.63 . . . . 2.55 110.277 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.655 ' O ' HG12 ' A' ' 15' ' ' ILE . 69.3 t -58.12 -51.53 69.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.39 110.981 178.248 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.95 -37.52 63.99 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.088 0.47 . . . . 0.35 111.155 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -68.69 -41.23 79.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.643 -0.708 . . . . 0.86 110.191 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 41.1 mm-40 -64.77 -47.41 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.572 -0.74 . . . . 2.05 111.907 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.756 HG23 HD21 ' A' ' 43' ' ' LEU . 3.4 mm -60.38 -49.87 82.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.887 0.375 . . . . 0.33 110.326 -175.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.6 ' HB3' HG21 ' A' ' 27' ' ' ILE . 23.1 p -61.16 -32.66 72.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.95 -0.568 . . . . 0.32 111.314 -176.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -70.54 -44.98 66.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.162 -0.472 . . . . 0.59 110.649 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 77.8 mtt180 -75.25 -31.36 60.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 2.83 111.693 -173.199 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.633 HD11 ' HB2' ' A' ' 70' ' ' PHE . 3.9 mm? -82.54 -15.56 51.86 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.623 -0.431 . . . . 0.99 111.173 174.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 55.18 29.91 13.54 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 108.395 -0.965 . . . . 1.6 108.395 -170.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.492 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 24.7 tt0 -71.73 132.96 84.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 113.904 -1.498 . . . . 1.31 112.271 -168.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.429 ' HD2' ' HG3' ' A' ' 21' ' ' GLU . 38.8 Cg_endo -63.47 -49.01 4.94 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 124.737 3.625 . . . . 0.41 113.625 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.604 ' HD2' ' HB3' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -89.99 69.81 7.41 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.006 0.908 . . . . 1.41 110.708 -175.314 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.505 ' O ' HG22 ' A' ' 27' ' ' ILE . 77.7 mttt -66.88 -23.82 66.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.175 . . . . 1.75 112.513 -170.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.37 -37.28 86.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.364 0.602 . . . . 2.14 110.021 175.093 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.604 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 1.4 tm? -72.93 -40.98 64.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.348 -0.842 . . . . 1.33 110.479 -178.063 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.6 HG21 ' HB3' ' A' ' 16' ' ' SER . 3.8 tp -63.09 -31.15 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 121.079 0.466 . . . . 0.44 109.919 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.656 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.48 -34.09 65.17 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.913 -0.585 . . . . 0.21 110.562 174.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -62.3 -41.38 98.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.211 -0.45 . . . . 1.48 110.923 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 34' ' ' ILE . 19.9 t -54.02 -44.59 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 N-CA-C 109.001 -0.74 . . . . 1.1 109.001 177.476 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.656 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 91.8 t -53.2 -49.04 53.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 114.34 -1.3 . . . . 0.22 111.038 175.389 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 32' ' ' ARG . 49.4 mtt180 -60.55 -47.48 86.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.586 -0.734 . . . . 3.75 110.862 -178.583 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 41.7 mm -73.94 -52.24 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.701 -0.681 . . . . 0.8 112.329 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.609 HG12 ' O ' ' A' ' 30' ' ' VAL . 21.4 pt -84.94 -28.86 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.628 -0.429 . . . . 0.4 111.944 -172.169 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.21 155.98 9.94 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.4 -0.905 . . . . 0.26 112.263 -179.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.474 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 4.7 p30 -59.51 -49.42 77.84 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.778 0.288 . . . . 0.91 111.778 -175.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -71.62 -33.67 69.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.811 0.339 . . . . 3.19 111.05 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.473 ' HB2' HG13 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -64.26 -31.68 72.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.038 -0.528 . . . . 2.45 110.832 -178.222 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.487 ' O ' ' HG ' ' A' ' 43' ' ' LEU . . . -64.15 -44.73 91.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.28 -0.418 . . . . 0.29 110.454 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.05 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.124 -0.489 . . . . 1.13 110.317 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 51.4 mt-10 -58.41 -42.95 88.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.127 -0.488 . . . . 2.1 110.822 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.839 ' HB3' HD13 ' A' ' 73' ' ' LEU . 53.1 mt -63.27 -37.87 88.95 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.512 -0.313 . . . . 0.29 110.847 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.756 HD21 HG23 ' A' ' 15' ' ' ILE . 85.6 mt -60.99 -30.78 70.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.073 0.463 . . . . 1.36 111.123 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.2 tmm? -73.99 -39.17 63.85 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.352 -0.611 . . . . 2.2 109.352 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 31.0 mt-10 -70.45 -25.49 63.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.658 -0.701 . . . . 1.83 112.464 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.655 HG22 HD11 ' A' ' 73' ' ' LEU . 71.2 p -52.04 -41.5 62.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.921 0.391 . . . . 1.03 110.717 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.56 -35.07 75.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.684 -0.689 . . . . 0.88 111.418 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -68.85 -33.93 74.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.984 0.421 . . . . 2.51 110.498 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 81.5 t -76.96 -35.81 24.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.967 0.413 . . . . 0.76 110.323 174.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.567 ' HA ' HH21 ' A' ' 64' ' ' ARG . 6.7 mm-40 -61.05 -43.56 98.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.042 -0.526 . . . . 1.96 111.361 177.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -69.81 -26.27 64.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.813 0.339 . . . . 2.25 110.782 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -83.17 -25.07 32.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 2.34 111.04 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.501 ' HA2' ' NH1' ' A' ' 64' ' ' ARG . . . 72.95 44.4 37.09 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.521 -0.763 . . . . 1.33 111.804 -178.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.43 126.01 7.09 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.248 -0.977 . . . . 0.89 114.865 -170.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.75 HD13 ' HB2' ' A' ' 72' ' ' ASN . 38.6 tp -176.87 127.72 0.17 Allowed 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.23 0.538 . . . . 1.38 111.72 163.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -119.27 112.69 19.79 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 107.971 -1.122 . . . . 2.87 107.971 163.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.589 HG12 ' HA ' ' A' ' 63' ' ' ARG . 1.1 pt -86.96 -165.36 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.805 -0.634 . . . . 0.68 111.516 -175.002 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.422 ' H ' ' HB ' ' A' ' 57' ' ' ILE . 3.9 mtt -42.12 -46.33 4.28 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.876 0.735 . . . . 0.91 111.806 -173.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -120.82 -33.27 3.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.101 -0.499 . . . . 2.28 111.193 -174.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.456 ' O ' ' HB3' ' A' ' 63' ' ' ARG . . . 106.16 -12.07 44.41 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.285 -0.96 . . . . 1.21 115.257 172.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 65.8 p -65.28 -55.88 15.85 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 118.46 1.13 . . . . 2.18 111.17 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.576 ' C ' HD11 ' A' ' 57' ' ' ILE . 60.4 mtp180 -81.71 26.9 0.47 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.528 -0.76 . . . . 2.89 110.368 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.589 ' HA ' HG12 ' A' ' 57' ' ' ILE . 25.8 ptt180 -46.53 133.39 10.15 Favored 'General case' 0 C--O 1.233 0.21 0 O-C-N 123.916 0.76 . . . . 3.59 112.434 -169.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.892 ' HD2' HG22 ' A' ' 69' ' ' VAL . 4.8 tpt180 73.14 80.67 0.13 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.002 -0.999 . . . . 1.98 111.817 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.873 HG23 ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER -105.36 147.72 35.08 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.885 -1.052 . . . . 0.44 108.279 172.127 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.481 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.9 Cg_endo -45.76 -59.69 1.1 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 123.536 2.824 . . . . 0.44 112.998 -176.033 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.689 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -63.31 -40.74 99.31 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.085 -1.055 . . . . 0.25 110.85 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.873 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.46 -29.56 57.43 Favored Glycine 0 CA--C 1.52 0.379 0 CA-C-N 115.139 -0.53 . . . . 0.3 113.289 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.892 HG22 ' HD2' ' A' ' 64' ' ' ARG . 41.5 t -67.75 -33.59 62.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.118 0.485 . . . . 0.74 109.997 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.633 ' HB2' HD11 ' A' ' 19' ' ' LEU . 12.1 t80 -65.23 -35.74 81.98 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.305 -0.628 . . . . 0.26 109.305 171.501 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.689 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.22 -36.26 72.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.462 -0.94 . . . . 0.32 108.462 178.532 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.75 ' HB2' HD13 ' A' ' 55' ' ' LEU . 44.0 t-20 -56.58 -35.21 67.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.651 -0.704 . . . . 1.08 109.9 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.839 HD13 ' HB3' ' A' ' 42' ' ' LEU . 95.6 mt -58.13 -37.01 73.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.153 -0.931 . . . . 0.46 112.178 -176.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.876 ' HB3' HG23 ' A' ' 85' ' ' ILE . 6.4 mp -65.83 -28.87 69.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.162 0.506 . . . . 1.08 110.479 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -80.92 -42.5 21.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.121 0.486 . . . . 1.93 110.648 176.715 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -100.28 26.12 6.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.728 -0.669 . . . . 2.12 111.363 -173.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.501 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 5.4 t -80.95 124.73 81.19 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 121.447 0.642 . . . . 0.94 110.517 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.4 Cg_exo -75.78 -9.97 19.83 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.29 2.66 . . . . 1.0 113.01 -176.62 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.5 m -111.51 -20.71 12.1 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.208 0.818 . . . . 1.49 113.208 -170.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.423 ' HB ' HG21 ' A' ' 77' ' ' THR . 17.7 mt -111.4 139.87 33.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.774 0.321 . . . . 1.21 111.313 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.8 t -76.17 142.0 41.69 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.31 0.576 . . . . 1.79 110.044 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.402 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 1.8 mp0 -57.23 -37.59 72.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.691 -1.141 . . . . 2.89 113.116 -168.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.54 -37.28 85.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 2.06 110.764 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -68.37 -23.64 64.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.587 0.708 . . . . 2.31 110.073 -177.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.876 HG23 ' HB3' ' A' ' 74' ' ' LEU . 46.5 mm -70.73 -36.96 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.839 -1.073 . . . . 1.41 111.169 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.555 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 37.4 ttmt -56.83 -36.15 69.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.485 -0.78 . . . . 2.45 111.896 -177.249 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.52 -33.29 69.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 1.7 111.629 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.7 mt -70.95 -72.21 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 113.167 0.803 . . . . 0.42 113.167 -170.589 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.728 ' H ' ' HD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -104.3 -19.19 14.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.695 0.628 . . . . 0.75 112.695 -166.854 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.555 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 60.5 t80 -74.83 -23.86 58.52 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.311 0.577 . . . . 1.13 110.945 -173.724 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 47.1 mt . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 115.605 -0.725 . . . . 0.86 111.022 -176.563 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.53 ' HB2' ' CG2' ' A' ' 11' ' ' VAL . 12.0 p-10 . . . . . 0 N--CA 1.451 -0.382 0 CA-C-O 121.713 0.768 . . . . 1.79 111.67 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.465 ' O ' HG23 ' A' ' 11' ' ' VAL . 17.5 m -79.86 127.87 32.75 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.443 -0.799 . . . . 1.33 109.363 175.279 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.714 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 14.2 pt20 -51.91 -43.65 63.49 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.731 1.011 . . . . 1.88 113.731 -167.194 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -71.36 -34.95 70.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.115 0.483 . . . . 2.17 110.268 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -65.67 -42.19 91.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 2.55 109.666 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.568 ' O ' HG12 ' A' ' 15' ' ' ILE . 60.2 t -62.15 -42.85 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.602 -0.726 . . . . 0.39 110.431 176.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.73 -41.7 77.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 0.35 111.36 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.27 -31.11 71.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.318 -0.401 . . . . 0.86 110.418 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.64 -50.54 64.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.463 -0.335 . . . . 2.05 110.779 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.861 HG23 HD21 ' A' ' 43' ' ' LEU . 2.0 mm -60.57 -49.48 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.768 0.318 . . . . 0.33 110.555 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.532 ' HB2' ' HD2' ' A' ' 24' ' ' LYS . 18.9 p -57.96 -43.04 86.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.864 -0.607 . . . . 0.32 111.454 -176.052 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.72 -41.52 98.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.666 -0.697 . . . . 0.59 111.141 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -77.42 -36.91 52.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 2.83 111.905 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.86 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.5 mm? -83.04 -5.61 59.17 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.973 0.36 . . . . 0.99 111.973 -178.167 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 55.82 39.97 30.68 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.762 -0.829 . . . . 1.6 108.762 -172.085 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.8 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.12 120.34 63.5 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.31 -1.313 . . . . 1.31 111.753 -171.065 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.429 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 71.6 Cg_endo -70.08 -34.96 12.55 Favored 'Trans proline' 0 N--CA 1.474 0.351 0 C-N-CA 123.976 3.117 . . . . 0.41 113.478 177.088 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.448 ' HE3' ' HG ' ' A' ' 26' ' ' LEU . 35.5 pttt -120.38 66.24 0.83 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.319 0.58 . . . . 1.41 109.499 -173.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.532 ' HD2' ' HB2' ' A' ' 16' ' ' SER . 40.1 mtmt -61.06 -12.41 11.78 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.035 1.124 . . . . 1.75 114.035 -163.265 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -69.23 -28.66 66.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.339 -0.544 . . . . 2.14 109.581 173.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.855 HD21 ' HA ' ' A' ' 89' ' ' PHE . 1.8 tm? -71.84 -52.05 19.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.46 -0.791 . . . . 1.33 109.926 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.8 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 10.1 tp -62.22 -34.58 64.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 0.44 110.525 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.71 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -70.88 -32.24 69.16 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.548 0.69 . . . . 0.21 110.477 174.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.43 ' O ' HG12 ' A' ' 33' ' ' ILE . 36.4 ttm180 -66.91 -41.6 86.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.548 -0.751 . . . . 1.48 111.587 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.729 HG21 ' HE1' ' A' ' 70' ' ' PHE . 16.3 t -53.4 -44.72 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 108.66 -0.867 . . . . 1.1 108.66 176.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.71 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.1 t -52.51 -53.42 20.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 113.63 -1.623 . . . . 0.22 111.201 175.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -66.24 -35.51 80.6 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.56 -0.745 . . . . 3.75 112.06 -174.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.636 HG13 HG12 ' A' ' 88' ' ' ILE . 50.5 mm -75.03 -51.82 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.294 0.479 . . . . 0.8 112.294 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.786 HG21 HD13 ' A' ' 80' ' ' ILE . 33.7 pt -90.18 -25.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.89 0.376 . . . . 0.4 111.854 -175.126 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.1 139.56 6.24 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.722 -0.751 . . . . 0.26 111.356 -175.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.714 ' HB3' ' HA ' ' A' ' 8' ' ' GLN . 0.9 OUTLIER -55.55 -37.95 68.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.834 0.349 . . . . 0.91 111.86 -179.195 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.47 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 34.0 ttmt -71.58 -33.87 69.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.145 0.498 . . . . 3.19 110.262 -178.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -69.86 -31.12 68.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.934 -0.576 . . . . 2.45 110.714 176.534 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.79 -38.66 91.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.13 0.49 . . . . 0.29 110.222 175.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.26 -41.65 93.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 115.912 -0.585 . . . . 1.13 110.441 176.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -55.73 -47.0 77.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.779 -0.646 . . . . 2.1 110.448 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.753 ' HB3' HD13 ' A' ' 73' ' ' LEU . 48.5 mt -60.58 -38.62 85.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.619 -0.719 . . . . 0.29 111.26 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.861 HD21 HG23 ' A' ' 15' ' ' ILE . 14.4 mt -60.05 -32.48 70.96 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.877 0.37 . . . . 1.36 111.498 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.8 mtp -74.59 -37.01 63.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.111 0.481 . . . . 2.2 109.881 175.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.418 ' O ' HG23 ' A' ' 49' ' ' VAL . 52.3 mt-10 -70.55 -27.45 64.15 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.444 -0.798 . . . . 1.83 111.623 179.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.534 HG23 HD11 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -62.87 -39.12 93.46 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.767 0.317 . . . . 1.03 110.833 -177.878 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.59 -44.15 89.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.53 . . . . 0.88 111.785 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.932 ' HA ' ' HG2' ' A' ' 51' ' ' GLN . 6.6 pt-20 -75.69 -30.27 59.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.671 -0.412 . . . . 2.51 111.422 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 45' ' ' GLU . 84.5 t -65.23 -35.62 75.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.496 0.665 . . . . 0.76 109.421 173.48 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.428 ' CG ' HG11 ' A' ' 69' ' ' VAL . 40.6 mt-10 -69.29 -47.02 65.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.553 -0.748 . . . . 1.96 111.121 175.393 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.932 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 17.0 pt20 -65.12 -27.04 68.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 2.25 110.728 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -94.27 -4.19 49.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.047 -0.524 . . . . 2.34 111.454 -177.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.23 50.08 41.76 Favored Glycine 0 C--N 1.331 0.28 0 CA-C-N 115.919 -0.582 . . . . 1.33 113.386 176.302 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -108.93 111.96 3.37 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.231 -0.985 . . . . 0.89 113.975 -177.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.763 HD21 HG23 ' A' ' 57' ' ' ILE . 34.6 tp -177.34 126.95 0.15 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.576 0.584 . . . . 1.38 112.576 167.178 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -125.65 93.54 3.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.592 -0.731 . . . . 2.87 109.081 164.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.763 HG23 HD21 ' A' ' 55' ' ' LEU . 3.8 pt -72.15 -170.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 112.451 0.537 . . . . 0.68 112.451 -176.322 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.417 ' H ' ' HB ' ' A' ' 57' ' ' ILE . 2.7 mtt -42.01 -47.63 4.46 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.88 0.738 . . . . 0.91 111.468 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.465 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 6.1 p30 -103.89 -35.81 8.02 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.797 -0.638 . . . . 2.28 111.746 -172.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 97.13 -19.52 54.47 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.069 -0.586 . . . . 1.21 113.701 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.465 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 66.1 m -72.61 -45.5 58.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.183 0.492 . . . . 2.18 111.251 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.746 ' HB3' HD11 ' A' ' 57' ' ' ILE . 7.4 ttm180 -80.47 49.37 1.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.91 0.862 . . . . 2.89 109.091 176.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.4 123.17 12.15 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.651 -1.159 . . . . 3.59 111.543 -173.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.742 ' HD2' HG22 ' A' ' 69' ' ' VAL . 1.2 mmm180 72.27 56.81 0.15 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 113.452 0.908 . . . . 1.98 113.452 173.121 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.714 HG23 ' HA3' ' A' ' 68' ' ' GLY . 3.9 t -77.74 140.65 63.51 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.657 -0.701 . . . . 0.44 109.159 169.228 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -48.18 -59.45 1.24 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 C-N-CA 124.047 3.165 . . . . 0.44 113.43 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.86 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -62.26 -39.86 98.26 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.868 -0.893 . . . . 0.25 110.868 177.22 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.714 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -58.94 -31.67 68.85 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.109 -0.546 . . . . 0.3 113.247 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.742 HG22 ' HD2' ' A' ' 64' ' ' ARG . 43.2 t -62.76 -36.39 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.181 0.515 . . . . 0.74 110.239 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.729 ' HE1' HG21 ' A' ' 30' ' ' VAL . 13.4 t80 -65.48 -36.37 83.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.955 -0.566 . . . . 0.26 109.634 173.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.619 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -59.4 -34.64 72.7 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.605 -0.887 . . . . 0.32 108.605 178.387 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.676 ' HB2' HD13 ' A' ' 55' ' ' LEU . 62.1 t30 -61.27 -30.41 70.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.266 -0.879 . . . . 1.08 110.489 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.753 HD13 ' HB3' ' A' ' 42' ' ' LEU . 71.1 mt -57.99 -36.09 72.14 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.296 -0.865 . . . . 0.46 111.885 -177.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.943 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.2 mp -60.83 -21.9 63.64 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.105 0.478 . . . . 1.08 110.859 -178.958 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.501 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -93.05 -38.45 11.62 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.989 -0.445 . . . . 1.93 111.576 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.63 ' OD1' ' HA ' ' A' ' 73' ' ' LEU . 2.9 p-10 -93.37 -8.14 42.73 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.914 -0.315 . . . . 2.12 111.648 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.55 HG21 ' HB ' ' A' ' 80' ' ' ILE . 7.9 t -56.22 127.65 70.98 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.436 0.636 . . . . 0.94 111.333 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.3 Cg_exo -76.07 -14.82 18.76 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.551 2.834 . . . . 1.0 113.055 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.6 m -112.31 -17.27 12.78 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.451 0.908 . . . . 1.49 113.451 -169.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.786 HD13 HG21 ' A' ' 34' ' ' ILE . 36.5 mt -103.84 139.98 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.03 0.443 . . . . 1.21 112.096 -169.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.425 ' O ' HG12 ' A' ' 85' ' ' ILE . 46.9 m -84.33 156.57 21.84 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.805 -0.634 . . . . 1.79 111.678 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.458 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 34.3 tt0 -65.92 -41.31 91.55 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.248 1.203 . . . . 2.89 114.248 -164.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.86 -47.03 85.13 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.55 -0.46 . . . . 2.06 111.63 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.571 ' O ' HG13 ' A' ' 88' ' ' ILE . 46.9 mt-30 -56.83 -33.56 66.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 2.31 110.528 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.943 HG23 ' HB3' ' A' ' 74' ' ' LEU . 36.3 mm -60.12 -50.74 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.796 -0.638 . . . . 1.41 110.652 177.562 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.8 ttpt -59.25 -39.1 81.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 2.45 110.753 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -65.84 -33.07 74.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.437 -0.347 . . . . 1.7 111.652 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.709 HG21 HG22 ' A' ' 30' ' ' VAL . 75.2 mt -70.44 -71.44 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.457 0.54 . . . . 0.42 112.457 -174.402 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.855 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -104.8 -10.78 17.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.32 0.859 . . . . 0.75 113.32 -165.836 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.536 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.9 t80 -89.46 -22.51 22.46 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.167 0.508 . . . . 1.13 110.947 -173.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.5 mt . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.092 -0.504 . . . . 0.86 110.852 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 . . . . . 0 N--CA 1.453 -0.321 0 CA-C-O 121.188 0.518 . . . . 1.79 109.944 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -56.03 131.84 48.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.463 -0.79 . . . . 1.33 109.427 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.574 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 96.7 mt-30 -58.44 -33.31 69.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.031 -0.531 . . . . 1.88 112.249 -173.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.15 -40.23 86.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.133 0.492 . . . . 2.17 110.42 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 62.5 tttm -70.24 -42.37 72.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.759 -0.655 . . . . 2.55 110.262 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.664 ' O ' HG12 ' A' ' 15' ' ' ILE . 91.1 t -59.26 -42.61 87.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.39 110.598 177.381 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.68 -41.42 73.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.038 0.447 . . . . 0.35 110.57 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -67.35 -42.12 84.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 0.86 110.426 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.568 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 71.6 mm-40 -56.86 -51.03 70.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.108 -0.496 . . . . 2.05 110.74 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.664 HG12 ' O ' ' A' ' 11' ' ' VAL . 4.6 mm -63.47 -51.8 66.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 120.709 -0.396 . . . . 0.33 110.318 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.679 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 31.4 p -64.03 -41.59 97.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.445 -0.343 . . . . 0.32 111.759 -172.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -62.54 -44.62 95.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.066 0.46 . . . . 0.59 110.646 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.2 mtt180 -78.73 -31.16 46.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.202 -0.454 . . . . 2.83 111.833 -175.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 1.07 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.3 mm? -77.56 -15.73 59.08 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 111.926 0.343 . . . . 0.99 111.926 177.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 57.15 41.22 27.48 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 107.65 -1.241 . . . . 1.6 107.65 -166.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.679 ' HB3' ' HA ' ' A' ' 16' ' ' SER . 7.2 tp10 -81.18 115.7 57.95 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 113.243 -1.799 . . . . 1.31 110.968 -170.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.444 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 42.2 Cg_endo -61.98 -47.88 9.66 Favored 'Trans proline' 0 N--CA 1.477 0.535 0 C-N-CA 124.416 3.411 . . . . 0.41 113.521 177.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.419 ' NZ ' HD11 ' A' ' 71' ' ' LEU . 45.1 pttt -92.59 72.52 5.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.058 0.932 . . . . 1.41 109.649 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.665 ' HA ' HG22 ' A' ' 27' ' ' ILE . 65.5 mttt -65.23 -17.66 64.67 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.428 -1.26 . . . . 1.75 111.441 -173.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.34 -39.06 59.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.418 -0.355 . . . . 2.14 110.524 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.444 ' O ' HD13 ' A' ' 26' ' ' LEU . 1.8 tm? -73.43 -43.61 60.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.003 0.43 . . . . 1.33 109.966 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.672 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 10.6 tp -64.08 -26.92 41.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.969 -0.56 . . . . 0.44 109.756 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.687 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.22 -33.31 65.27 Favored 'General case' 0 CA--C 1.523 -0.073 0 CA-C-N 116.267 -0.424 . . . . 0.21 110.934 172.288 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.637 ' HG2' HG23 ' A' ' 88' ' ' ILE . 6.3 ttm180 -59.35 -45.74 90.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.718 0.266 . . . . 1.48 111.718 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.66 ' O ' HG12 ' A' ' 34' ' ' ILE . 9.5 p -57.55 -36.71 54.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.594 -0.521 . . . . 1.1 109.594 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.687 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 76.8 t -54.87 -50.51 61.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.112 -0.949 . . . . 0.22 110.779 173.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -63.49 -43.19 97.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.398 -0.819 . . . . 3.75 111.41 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.843 HD12 HG12 ' A' ' 88' ' ' ILE . 17.2 mt -74.96 -51.89 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.02 0.748 . . . . 0.8 113.02 -172.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 30' ' ' VAL . 34.1 pt -88.34 -28.2 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 120.274 -0.57 . . . . 0.4 111.661 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 153.86 8.66 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.363 -0.922 . . . . 0.26 112.492 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.574 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 24.7 p-10 -61.44 -40.25 93.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.672 0.272 . . . . 0.91 111.112 -179.261 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 87.2 tttt -72.06 -41.68 67.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.364 -0.38 . . . . 3.19 110.657 -178.624 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.574 ' HB3' HD12 ' A' ' 34' ' ' ILE . 13.8 mmmt -64.67 -27.72 69.12 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.114 -0.234 . . . . 2.45 111.365 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.4 ' O ' ' HG ' ' A' ' 43' ' ' LEU . . . -67.34 -40.2 85.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.053 0.454 . . . . 0.29 109.904 174.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 36' ' ' ASN . 45.3 mm -70.08 -40.13 78.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.079 176.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 15.5 mm-40 -58.65 -43.25 89.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.841 -0.618 . . . . 2.1 110.395 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.75 HD22 ' HB3' ' A' ' 73' ' ' LEU . 34.8 mt -59.98 -33.76 72.39 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.254 -0.43 . . . . 0.29 110.846 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.564 HD21 HG23 ' A' ' 15' ' ' ILE . 63.1 mt -62.91 -32.42 73.7 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.879 -0.328 . . . . 1.36 110.553 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.7 mmm -76.97 -39.64 49.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.935 0.398 . . . . 2.2 110.072 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.8 mt-10 -60.5 -27.18 67.39 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.699 -0.682 . . . . 1.83 111.501 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.556 HG23 ' O ' ' A' ' 42' ' ' LEU . 72.4 p -56.86 -37.48 71.38 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-O 120.607 0.241 . . . . 1.03 110.806 177.727 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -60.67 -37.58 82.06 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.057 -0.52 . . . . 0.88 111.754 -173.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.57 -37.2 82.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.939 0.399 . . . . 2.51 110.03 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.757 HG12 HH12 ' A' ' 64' ' ' ARG . 61.4 t -76.28 -32.65 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.023 0.44 . . . . 0.76 110.194 176.169 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.983 ' HA ' HH22 ' A' ' 64' ' ' ARG . 33.3 mm-40 -59.64 -48.56 81.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 1.96 111.541 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -69.89 -21.52 63.31 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.984 0.365 . . . . 2.25 111.984 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -96.99 -25.84 15.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.964 0.411 . . . . 2.34 112.001 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.27 45.62 14.52 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 116.011 -0.54 . . . . 1.33 113.506 176.535 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -102.29 129.01 9.74 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.488 -0.863 . . . . 0.89 114.5 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.925 HD13 ' HB2' ' A' ' 72' ' ' ASN . 58.9 tp -176.58 127.77 0.19 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.229 0.538 . . . . 1.38 112.16 165.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -121.33 108.88 14.23 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.563 -1.273 . . . . 2.87 107.563 162.249 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.834 HG23 HD21 ' A' ' 55' ' ' LEU . 0.9 OUTLIER -80.89 -174.93 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.426 -0.352 . . . . 0.68 111.904 -174.102 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -33.46 64.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.68 0.622 . . . . 0.91 112.68 -173.156 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -89.65 -36.46 15.24 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.179 -0.608 . . . . 2.28 112.166 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.85 -15.34 32.36 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.734 -0.547 . . . . 1.21 111.734 -175.698 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.0 m -72.58 -59.85 2.52 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.32 0.581 . . . . 2.18 110.961 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -85.09 145.69 27.52 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 106.255 -1.757 . . . . 2.89 106.255 167.067 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -132.27 130.97 41.59 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 119.358 -0.937 . . . . 3.59 110.645 -177.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.983 HH22 ' HA ' ' A' ' 50' ' ' GLU . 9.2 tpt180 69.95 88.13 0.11 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.932 0.872 . . . . 1.98 112.359 172.686 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.764 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.3 t -110.37 147.49 36.46 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.83 -1.077 . . . . 0.44 109.072 172.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -45.25 -58.85 1.38 Allowed 'Trans proline' 0 N--CA 1.486 1.077 0 C-N-CA 123.939 3.093 . . . . 0.44 113.29 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 1.07 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -63.46 -42.29 99.04 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 110.545 -1.022 . . . . 0.25 110.545 176.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.764 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.56 -28.93 56.91 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.667 -0.767 . . . . 0.3 113.403 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.913 HG22 ' HD2' ' A' ' 64' ' ' ARG . 22.7 t -67.53 -36.67 77.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.199 0.523 . . . . 0.74 110.008 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.575 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 7.6 t80 -66.08 -37.31 85.46 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.792 -0.64 . . . . 0.26 109.438 171.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.22 -36.8 73.68 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 108.21 -1.033 . . . . 0.32 108.21 176.249 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.925 ' HB2' HD13 ' A' ' 55' ' ' LEU . 65.3 t30 -60.31 -30.91 69.8 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.133 -0.94 . . . . 1.08 110.302 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.75 ' HB3' HD22 ' A' ' 42' ' ' LEU . 50.5 mt -60.77 -39.53 89.15 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.831 -0.622 . . . . 0.46 112.008 -178.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.78 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.3 mp -57.68 -34.94 69.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.055 0.455 . . . . 1.08 110.807 -178.217 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.731 ' HG2' ' O ' ' A' ' 72' ' ' ASN . 0.3 OUTLIER -93.72 -6.02 47.13 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.209 -0.307 . . . . 1.93 110.828 -177.145 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -115.21 -27.87 7.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.516 -0.311 . . . . 2.12 111.759 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.529 HG23 ' HB ' ' A' ' 80' ' ' ILE . 13.8 t -58.0 117.68 21.29 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-O 122.011 0.91 . . . . 0.94 110.201 -177.385 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.1 Cg_exo -72.94 -15.71 26.16 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 123.511 2.808 . . . . 1.0 113.857 -161.11 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 40.0 t -105.96 5.5 30.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.672 0.273 . . . . 1.49 111.649 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.529 ' HB ' HG23 ' A' ' 77' ' ' THR . 34.0 mm -115.78 139.26 43.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.616 0.246 . . . . 1.21 110.792 -176.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.495 ' O ' HG12 ' A' ' 85' ' ' ILE . 39.2 t -78.68 140.96 38.3 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.204 0.526 . . . . 1.79 110.863 -177.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.29 -34.47 78.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 114.92 -1.036 . . . . 2.89 111.949 -175.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.78 -43.66 98.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.116 0.484 . . . . 2.06 110.551 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.15 -28.53 70.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.56 -0.746 . . . . 2.31 110.398 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.78 HG23 ' HB3' ' A' ' 74' ' ' LEU . 47.1 mm -69.88 -34.42 60.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.19 -0.914 . . . . 1.41 111.461 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.535 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.7 tmmm? -58.78 -34.85 71.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.093 0.473 . . . . 2.45 110.215 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.88 -31.31 67.93 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.922 -0.581 . . . . 1.7 111.087 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.843 HG12 HD12 ' A' ' 33' ' ' ILE . 34.8 mt -68.72 -67.82 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.625 0.602 . . . . 0.42 112.625 -173.137 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.539 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -112.29 -9.28 13.89 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.515 0.931 . . . . 0.75 113.515 -169.315 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.539 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 82.7 t80 -87.91 -24.87 23.5 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.076 0.465 . . . . 1.13 110.751 -174.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.439 HG22 ' O ' ' A' ' 91' ' ' ILE . 24.2 mt . . . . . 0 C--N 1.324 -0.531 0 CA-C-O 121.797 0.808 . . . . 0.86 109.864 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.423 ' HB3' HG13 ' A' ' 40' ' ' ILE . 5.1 p30 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 121.168 0.508 . . . . 1.79 111.14 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB2' ' HB3' ' A' ' 10' ' ' LYS . 0.3 OUTLIER -63.24 119.28 9.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.663 -0.495 . . . . 1.33 109.663 175.628 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.465 ' CD ' ' H ' ' A' ' 8' ' ' GLN . 21.6 mp0 -49.54 -47.97 48.67 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.098 0.407 . . . . 1.88 112.098 -167.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.83 -51.09 63.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.822 0.344 . . . . 2.17 110.915 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 7' ' ' SER . 34.3 tttm -55.28 -48.11 74.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.725 -0.67 . . . . 2.55 110.793 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.778 ' O ' HG12 ' A' ' 15' ' ' ILE . 72.2 t -60.33 -53.41 49.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.845 -0.616 . . . . 0.39 110.302 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB1' ' CB ' ' A' ' 28' ' ' ALA . . . -53.86 -39.29 65.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.261 0.553 . . . . 0.35 111.256 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.43 -45.46 76.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.494 -0.775 . . . . 0.86 110.625 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.57 ' HG2' ' HA ' ' A' ' 11' ' ' VAL . 15.4 pt-20 -76.39 -26.54 55.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.151 -0.477 . . . . 2.05 112.06 -176.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.778 HG12 ' O ' ' A' ' 11' ' ' VAL . 28.3 mm -56.34 -53.75 36.26 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 N-CA-C 108.946 -0.761 . . . . 0.33 108.946 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.673 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 22.0 p -66.52 -33.87 76.64 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.148 -0.933 . . . . 0.32 111.076 -178.249 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . 0.408 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 74.0 t80 -58.61 -41.7 86.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.054 -0.521 . . . . 0.59 110.451 175.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 52.7 mtt180 -77.74 -31.97 52.44 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.351 -0.386 . . . . 2.83 110.859 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.463 HD23 ' N ' ' A' ' 19' ' ' LEU . 0.7 OUTLIER -82.67 -20.48 36.11 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.068 -0.515 . . . . 0.99 111.629 -174.688 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 58.64 33.93 23.45 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.12 -1.067 . . . . 1.6 108.12 -164.201 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.673 ' HB2' ' HA ' ' A' ' 16' ' ' SER . 0.3 OUTLIER -61.58 130.68 92.27 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 113.375 -1.739 . . . . 1.31 112.396 -173.203 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 88.2 Cg_endo -72.57 -33.04 8.99 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 124.125 3.217 . . . . 0.41 113.47 172.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HD2' HD13 ' A' ' 26' ' ' LEU . 42.6 pttt -113.35 67.81 0.67 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.084 0.945 . . . . 1.41 109.679 -174.702 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -66.16 -17.8 64.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.32 -1.309 . . . . 1.75 111.49 -172.87 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -76.19 -39.39 54.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.316 -0.402 . . . . 2.14 110.359 175.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.5 HD13 ' HD2' ' A' ' 23' ' ' LYS . 5.2 tt -73.58 -36.49 65.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.797 -0.446 . . . . 1.33 109.797 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.574 HG21 ' HB3' ' A' ' 16' ' ' SER . 1.9 tp -65.77 -27.51 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.626 -0.509 . . . . 0.44 109.626 176.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.707 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.3 -34.57 63.54 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.318 0.58 . . . . 0.21 110.363 171.635 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 16.7 ttm180 -61.37 -47.82 84.1 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.498 -0.774 . . . . 1.48 111.5 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.715 ' O ' HG12 ' A' ' 34' ' ' ILE . 12.7 p -58.49 -37.26 63.35 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.082 0 N-CA-C 109.73 -0.47 . . . . 1.1 109.73 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.707 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 41.1 t -52.57 -53.57 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.426 -0.807 . . . . 0.22 110.371 173.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.87 -42.41 99.75 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.347 -0.842 . . . . 3.75 111.052 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.596 HD12 HG12 ' A' ' 88' ' ' ILE . 32.7 mt -75.38 -52.15 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 113.312 0.856 . . . . 0.8 113.312 -174.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.715 HG12 ' O ' ' A' ' 30' ' ' VAL . 31.4 pt -82.3 -21.99 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.195 -0.602 . . . . 0.4 111.083 -176.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.33 146.45 9.24 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.584 -0.817 . . . . 0.26 111.438 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.433 ' O ' HG12 ' A' ' 40' ' ' ILE . 9.8 p-10 -63.42 -40.3 96.82 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 122.394 0.278 . . . . 0.91 111.519 -177.381 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.79 ' HD2' ' H ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -72.26 -34.01 67.92 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.802 -0.359 . . . . 3.19 110.991 178.694 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.671 ' HG3' HD12 ' A' ' 34' ' ' ILE . 14.6 tppt? -61.7 -42.0 98.35 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 110.145 -0.317 . . . . 2.45 110.145 176.166 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.463 ' O ' HD22 ' A' ' 43' ' ' LEU . . . -60.44 -42.39 96.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.051 -0.522 . . . . 0.29 110.49 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 36' ' ' ASN . 41.9 mm -61.37 -42.6 94.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.625 177.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 37' ' ' LYS . 46.9 mt-10 -61.22 -38.23 85.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.236 -0.438 . . . . 2.1 110.429 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.962 HD22 ' HB3' ' A' ' 73' ' ' LEU . 75.3 mt -65.41 -31.04 71.93 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.105 -0.498 . . . . 0.29 111.378 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.659 HD21 HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -62.35 -28.93 70.1 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.922 -0.486 . . . . 1.36 110.793 175.898 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.8 mtp -75.4 -35.21 61.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.322 0.582 . . . . 2.2 109.794 171.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.597 ' HB2' HD13 ' A' ' 73' ' ' LEU . 11.0 mm-40 -70.04 -26.8 64.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.536 -0.756 . . . . 1.83 111.461 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 43.3 p -57.01 -47.58 80.53 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.365 -0.606 . . . . 1.03 109.365 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -64.57 -35.81 82.18 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.837 -0.619 . . . . 0.88 110.914 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.668 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 21.9 tp10 -59.2 -49.3 78.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.925 -0.579 . . . . 2.51 109.566 176.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 79.7 t -70.58 -33.38 53.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.184 -0.462 . . . . 0.76 110.821 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.733 ' HA ' HH22 ' A' ' 64' ' ' ARG . 6.4 mm-40 -59.94 -34.48 73.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.6 -0.273 . . . . 1.96 111.612 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.668 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.1 pt20 -83.1 -24.03 32.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 2.25 110.644 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -88.8 -27.59 21.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 2.34 111.176 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.58 50.27 38.26 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 115.745 -0.661 . . . . 1.33 113.352 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.428 ' N ' ' HE ' ' A' ' 64' ' ' ARG . . . -132.28 121.24 2.94 Favored Glycine 0 C--O 1.223 -0.55 0 C-N-CA 119.706 -1.235 . . . . 0.89 114.225 -177.006 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 1.038 HD11 HG23 ' A' ' 57' ' ' ILE . 1.9 tm? -165.23 125.51 1.88 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.885 0.374 . . . . 1.38 110.165 171.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.525 ' N ' HD22 ' A' ' 55' ' ' LEU . 90.1 m-85 -119.16 113.73 21.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.77 -0.826 . . . . 2.87 108.77 171.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.038 HG23 HD11 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -87.37 -161.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.72 -0.673 . . . . 0.68 111.976 -175.493 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.439 ' H ' ' HB ' ' A' ' 57' ' ' ILE . 3.2 mtt -44.49 -48.71 10.1 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 123.759 0.662 . . . . 0.91 110.949 -175.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -107.98 -28.32 9.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.738 -0.665 . . . . 2.28 111.338 177.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.88 -18.84 37.14 Favored Glycine 0 C--O 1.224 -0.505 0 C-N-CA 120.853 -0.689 . . . . 1.21 112.888 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.5 m -56.76 -45.95 81.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.161 0.43 . . . . 2.18 112.161 178.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.441 ' O ' HD11 ' A' ' 57' ' ' ILE . 35.2 mtp180 -84.43 43.17 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.932 0.873 . . . . 2.89 109.326 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 63' ' ' ARG . 38.4 ttp180 -47.01 130.06 12.17 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 113.552 -1.658 . . . . 3.59 112.611 -170.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.733 HH22 ' HA ' ' A' ' 50' ' ' GLU . 0.1 OUTLIER 64.13 71.82 0.47 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.248 -0.887 . . . . 1.98 112.822 -178.274 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.833 HG23 ' HA3' ' A' ' 68' ' ' GLY . 3.1 t -90.49 140.76 26.88 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 107.973 -1.121 . . . . 0.44 107.973 166.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -47.7 -58.16 1.9 Allowed 'Trans proline' 0 N--CA 1.48 0.72 0 C-N-CA 123.581 2.854 . . . . 0.44 113.262 -171.207 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.658 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -69.29 -40.33 81.07 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.284 -0.96 . . . . 0.25 111.245 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.833 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -55.97 -28.2 52.75 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.515 -0.342 . . . . 0.3 113.075 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.73 HG22 ' HD2' ' A' ' 64' ' ' ARG . 70.4 t -63.09 -39.02 83.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.144 0.497 . . . . 0.74 110.69 176.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.443 ' CG ' HD11 ' A' ' 19' ' ' LEU . 6.9 t80 -66.32 -34.84 78.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.219 -0.446 . . . . 0.26 110.022 172.06 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.677 ' HG ' ' HA2' ' A' ' 68' ' ' GLY . 0.1 OUTLIER -55.3 -33.52 63.35 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 108.658 -0.867 . . . . 0.32 108.658 176.705 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.847 ' HB2' HD23 ' A' ' 55' ' ' LEU . 27.8 t-20 -56.06 -40.53 73.68 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.954 -0.566 . . . . 1.08 109.976 174.135 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.962 ' HB3' HD22 ' A' ' 42' ' ' LEU . 34.5 mt -67.91 -38.15 82.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.599 -0.728 . . . . 0.46 111.031 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.669 ' O ' HD12 ' A' ' 85' ' ' ILE . 5.0 tt -57.56 -38.95 75.63 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.817 -1.083 . . . . 1.08 109.734 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.686 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 12.6 pttt -93.89 -31.22 14.41 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.757 0.651 . . . . 1.93 112.757 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 72' ' ' ASN . 8.1 m-20 -97.28 19.97 12.26 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.838 0.31 . . . . 2.12 111.838 -174.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.681 HG21 HD12 ' A' ' 80' ' ' ILE . 4.1 t -68.44 120.2 73.48 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 109.118 -0.697 . . . . 0.94 109.118 172.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.516 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 9.3 Cg_exo -71.8 -9.47 24.87 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 123.077 2.518 . . . . 1.0 114.029 -166.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 77.3 p -111.23 1.25 17.09 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.118 0.414 . . . . 1.49 112.118 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.681 HD12 HG21 ' A' ' 77' ' ' THR . 47.3 mt -119.93 140.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 1.21 111.493 -175.859 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' SER . . . . . 0.416 ' O ' HG12 ' A' ' 85' ' ' ILE . 23.3 t -82.46 154.75 24.97 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.566 0.698 . . . . 1.79 111.003 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.427 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 27.9 tt0 -60.71 -34.06 73.81 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.466 -1.243 . . . . 2.89 113.182 -167.911 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -63.0 -46.91 85.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.842 0.312 . . . . 2.06 111.842 -175.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.96 -32.55 72.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.209 0.528 . . . . 2.31 109.997 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.669 HD12 ' O ' ' A' ' 74' ' ' LEU . 30.8 mm -61.57 -44.93 99.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.169 -0.923 . . . . 1.41 110.963 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.58 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 36.4 ttpt -57.25 -40.69 78.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.505 -0.77 . . . . 2.45 111.516 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.92 -31.34 72.53 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.778 -0.646 . . . . 1.7 110.971 -174.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.596 HG12 HD12 ' A' ' 33' ' ' ILE . 44.8 mt -70.0 -71.37 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.601 0.593 . . . . 0.42 112.601 -175.064 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.509 ' CD1' HD13 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -110.57 -15.7 13.82 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.419 0.896 . . . . 0.75 113.419 -168.368 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 81.7 t80 -71.58 -27.32 63.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.378 0.608 . . . . 1.13 110.614 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 43.2 mt . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.467 -0.788 . . . . 0.86 111.174 -178.808 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.404 ' HB3' HD12 ' A' ' 40' ' ' ILE . 6.5 p-10 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 121.813 0.816 . . . . 1.79 110.69 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.48 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.2 m -72.28 130.37 40.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.317 -0.856 . . . . 1.33 110.27 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.569 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 52.5 mt-30 -47.91 -47.6 32.11 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.275 0.843 . . . . 1.88 113.275 -169.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -67.69 -39.15 84.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.751 0.31 . . . . 2.17 111.259 -176.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -70.11 -36.43 74.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.429 -0.35 . . . . 2.55 110.576 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.667 ' O ' HG12 ' A' ' 15' ' ' ILE . 85.9 t -58.14 -41.38 80.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.194 -0.457 . . . . 0.39 110.794 177.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -44.27 82.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.029 0.443 . . . . 0.35 111.157 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.06 -33.78 72.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.977 -0.556 . . . . 0.86 110.203 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -63.01 -43.9 97.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.645 -0.707 . . . . 2.05 110.647 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.704 HD13 HD11 ' A' ' 43' ' ' LEU . 5.0 mm -64.72 -51.0 72.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 N-CA-C 109.894 -0.41 . . . . 0.33 109.894 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.661 ' HB3' HG21 ' A' ' 27' ' ' ILE . 16.3 p -62.98 -40.55 98.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.32 111.267 -174.604 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -61.92 -45.16 94.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.59 111.178 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -74.2 -34.23 63.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.748 0.308 . . . . 2.83 111.785 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.477 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 29.1 mt -82.49 -13.84 56.01 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.441 -0.345 . . . . 0.99 111.915 -176.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 61.51 32.04 18.85 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 108.333 -0.988 . . . . 1.6 108.333 -170.078 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.732 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 7.6 tp10 -59.39 116.44 16.29 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 114.135 -1.393 . . . . 1.31 112.171 -172.274 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.519 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 59.9 Cg_endo -67.07 -46.58 2.99 Favored 'Trans proline' 0 N--CA 1.472 0.26 0 C-N-CA 124.066 3.177 . . . . 0.41 113.049 173.005 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -100.88 67.91 1.25 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.737 0.779 . . . . 1.41 109.894 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.33 -17.95 56.25 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.128 -0.942 . . . . 1.75 112.255 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -57.54 -40.74 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 2.14 110.182 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.667 HD21 ' HA ' ' A' ' 89' ' ' PHE . 3.2 tm? -73.02 -45.52 57.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.396 -0.82 . . . . 1.33 110.334 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.732 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.0 tp -68.05 -28.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.997 -0.547 . . . . 0.44 111.083 -175.022 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.625 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.45 -34.67 60.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.41 . . . . 0.21 110.563 172.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.46 ' O ' HG12 ' A' ' 33' ' ' ILE . 12.6 ttm180 -63.08 -45.98 89.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 1.48 111.476 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 34' ' ' ILE . 12.5 p -55.64 -38.69 51.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.094 0.473 . . . . 1.1 109.878 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.625 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 65.3 t -54.87 -50.64 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.167 -0.924 . . . . 0.22 110.571 173.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.09 -40.81 95.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.141 -0.936 . . . . 3.75 110.959 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.625 HG13 HG12 ' A' ' 88' ' ' ILE . 39.1 mm -74.42 -48.54 35.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 115.993 -0.549 . . . . 0.8 112.236 -175.726 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 30' ' ' VAL . 32.0 pt -91.33 -29.1 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 120.379 -0.529 . . . . 0.4 112.288 -174.392 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.15 161.88 11.83 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.561 -0.828 . . . . 0.26 112.612 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.569 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 2.5 p-10 -65.07 -52.67 54.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.785 0.326 . . . . 0.91 111.72 -178.279 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -71.63 -32.9 68.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.924 0.392 . . . . 3.19 110.396 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -67.8 -29.91 69.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 2.45 111.056 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.69 -39.99 84.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 0.29 110.178 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.404 HD12 ' HB3' ' A' ' 6' ' ' ASP . 30.2 mt -69.34 -32.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.517 . . . . 1.13 110.911 176.644 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -58.72 -38.55 78.58 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.099 -0.334 . . . . 2.1 110.099 173.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.845 ' HB3' HD13 ' A' ' 73' ' ' LEU . 68.4 mt -71.41 -35.2 70.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.431 -0.35 . . . . 0.29 110.204 174.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.704 HD11 HD13 ' A' ' 15' ' ' ILE . 41.1 mt -63.99 -29.93 71.05 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.201 0.524 . . . . 1.36 111.545 176.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.8 tpp -75.97 -35.32 59.7 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.327 0.584 . . . . 2.2 109.684 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -69.87 -34.38 73.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.292 -0.867 . . . . 1.83 111.501 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' THR . . . . . 1.086 HG23 HD11 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -52.0 -36.61 50.42 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 112.097 0.406 . . . . 1.03 112.097 -176.451 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.51 85.4 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.628 0.233 . . . . 0.88 111.628 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.45 -30.6 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.402 0.62 . . . . 2.51 110.276 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.1 t -76.38 -44.86 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.363 -0.835 . . . . 0.76 110.546 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -56.14 -49.03 75.08 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.225 -0.898 . . . . 1.96 112.218 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -60.75 -29.37 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 2.25 111.906 -173.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -91.75 -25.22 19.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.976 0.417 . . . . 2.34 111.636 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.08 -14.63 18.97 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.21 -0.519 . . . . 1.33 112.104 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 40.31 -81.91 0.0 OUTLIER Glycine 0 CA--C 1.528 0.899 0 N-CA-C 117.657 1.823 . . . . 0.89 117.657 167.249 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 1.059 HD11 HG23 ' A' ' 57' ' ' ILE . 2.8 tm? -74.85 132.01 41.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 115.252 1.575 . . . . 1.38 115.252 -156.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.57 ' N ' HD22 ' A' ' 55' ' ' LEU . 74.3 t80 -123.34 114.19 19.85 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.425 -1.261 . . . . 2.87 107.644 159.158 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.059 HG23 HD11 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -87.61 -172.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 114.125 1.158 . . . . 0.68 114.125 -168.611 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.39 -47.26 76.12 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 115.174 -0.921 . . . . 0.91 112.754 -172.056 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -91.62 -27.72 17.96 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 119.776 -0.77 . . . . 2.28 111.468 176.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.424 ' HA3' ' CZ ' ' A' ' 56' ' ' PHE . . . 82.61 -13.44 41.71 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.904 -0.665 . . . . 1.21 113.768 176.24 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.2 m -46.37 -58.48 3.69 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 122.89 0.476 . . . . 2.18 111.833 -177.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HG3' HD11 ' A' ' 57' ' ' ILE . 3.5 ptp180 -99.89 104.71 16.38 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.223 -0.658 . . . . 2.89 109.223 173.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -72.57 127.18 31.78 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.563 -0.455 . . . . 3.59 110.502 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.756 ' HA ' ' HB3' ' A' ' 55' ' ' LEU . 8.9 tpt85 71.22 98.74 0.07 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.968 -1.014 . . . . 1.98 112.814 175.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' THR . . . . . 1.003 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.1 t -109.31 147.85 36.83 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 114.268 -1.333 . . . . 0.44 108.862 168.241 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -51.51 -59.05 1.27 Allowed 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.124 2.55 . . . . 0.44 113.076 -175.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.586 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -66.22 -36.27 91.55 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.294 -0.955 . . . . 0.25 110.721 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 1.003 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.18 -32.06 59.74 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.911 -0.645 . . . . 0.3 112.927 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.675 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 0.4 OUTLIER -65.26 -32.57 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 117.459 0.63 . . . . 0.74 110.101 -178.683 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.57 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 18.6 t80 -67.42 -37.67 83.41 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.571 -0.529 . . . . 0.26 109.571 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.586 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -62.37 -34.78 77.36 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.381 -1.34 . . . . 0.32 107.381 176.549 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.733 ' HB2' HD23 ' A' ' 55' ' ' LEU . 65.7 t30 -59.67 -31.4 69.51 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 115.19 -0.914 . . . . 1.08 109.852 175.527 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 1.086 HD11 HG23 ' A' ' 46' ' ' THR . 87.8 mt -62.02 -33.1 73.73 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 115.683 -0.69 . . . . 0.46 111.956 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.665 ' HB3' HG23 ' A' ' 85' ' ' ILE . 42.1 mt -64.32 -21.28 66.56 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.381 -0.528 . . . . 1.08 110.395 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.519 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -85.19 -15.29 44.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 1.93 110.641 173.468 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -115.02 4.45 14.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 2.12 111.428 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.62 HG23 ' HB ' ' A' ' 80' ' ' ILE . 9.7 t -72.93 114.34 29.82 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 121.758 0.79 . . . . 0.94 109.968 -175.496 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 6.2 Cg_exo -72.94 -22.16 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 123.039 2.492 . . . . 1.0 113.499 -165.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 30.2 m -112.85 17.4 19.01 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.09 0.774 . . . . 1.49 113.09 -173.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.62 ' HB ' HG23 ' A' ' 77' ' ' THR . 41.0 mm -118.3 135.9 57.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.115 0.484 . . . . 1.21 111.724 -177.157 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.3 p -75.89 148.91 37.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.743 -0.662 . . . . 1.79 110.344 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -57.06 -34.48 68.3 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.848 -1.069 . . . . 2.89 112.962 -169.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -70.29 -42.69 71.72 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.144 -0.222 . . . . 2.06 111.309 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.597 ' O ' HG13 ' A' ' 88' ' ' ILE . 91.7 mt-30 -60.93 -34.46 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.934 0.397 . . . . 2.31 110.13 177.197 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.665 HG23 ' HB3' ' A' ' 74' ' ' LEU . 60.4 mt -60.69 -51.15 76.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 1.41 110.049 175.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.555 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 27.1 ttpt -54.64 -42.47 71.29 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.831 -0.622 . . . . 2.45 110.512 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.44 -35.96 79.03 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.183 -0.917 . . . . 1.7 111.714 -175.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.625 HG12 HG13 ' A' ' 33' ' ' ILE . 62.9 mt -70.94 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 112.273 0.471 . . . . 0.42 112.273 -177.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.667 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -103.4 -18.9 14.63 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.613 0.968 . . . . 0.75 113.613 -166.683 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.555 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 60.4 t80 -77.05 -38.94 51.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.864 0.364 . . . . 1.13 110.632 -175.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 43.4 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.251 0.548 . . . . 0.86 110.843 -179.451 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 . . . . . 0 N--CA 1.451 -0.376 0 CA-C-O 122.032 0.92 . . . . 1.79 109.33 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.415 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.8 m -58.95 128.55 37.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.873 -1.058 . . . . 1.33 110.242 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.809 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 49.9 mt-30 -53.23 -34.15 55.91 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.551 -0.75 . . . . 1.88 112.229 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.2 -48.21 68.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.833 0.349 . . . . 2.17 110.529 178.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -70.1 -35.85 74.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 2.55 110.727 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.696 ' O ' HG12 ' A' ' 15' ' ' ILE . 75.0 t -57.88 -56.49 15.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.05 -0.352 . . . . 0.39 110.05 176.639 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.43 -37.82 70.73 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.356 0.598 . . . . 0.35 110.962 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -61.57 -39.07 89.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.284 -0.871 . . . . 0.86 111.161 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HG2' ' HD2' ' A' ' 18' ' ' ARG . 33.3 tt0 -77.78 -41.2 38.21 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.034 0.383 . . . . 2.05 112.034 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.696 HG12 ' O ' ' A' ' 11' ' ' VAL . 7.0 mm -55.91 -50.85 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.029 0.443 . . . . 0.33 110.336 -175.116 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.645 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 7.8 p -57.59 -39.59 77.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.396 -0.82 . . . . 0.32 111.313 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -66.46 -45.58 79.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.116 -0.493 . . . . 0.59 110.88 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.406 ' HD2' ' HG2' ' A' ' 14' ' ' GLU . 34.2 mtp180 -65.42 -43.21 91.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.91 -0.586 . . . . 2.83 111.723 -175.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.589 HD12 ' HA2' ' A' ' 67' ' ' GLY . 3.3 mm? -83.05 -7.57 59.64 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.14 0.422 . . . . 0.99 112.14 -178.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 56.16 37.18 28.58 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.009 -1.108 . . . . 1.6 108.009 -169.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.788 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 5.5 tp10 -60.84 117.02 21.37 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 113.168 -1.833 . . . . 1.31 111.309 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.47 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 48.9 Cg_endo -64.16 -44.17 13.02 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 123.708 2.939 . . . . 0.41 112.862 174.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.528 ' HG3' ' OE2' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -104.49 72.37 1.04 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.74 1.257 . . . . 1.41 110.014 -175.792 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.494 ' O ' HG22 ' A' ' 27' ' ' ILE . 31.6 mtmm -66.12 -18.38 65.31 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.565 -1.652 . . . . 1.75 112.707 -167.389 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.21 -33.08 69.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.124 0.487 . . . . 2.14 109.732 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.903 HD11 ' HA ' ' A' ' 89' ' ' PHE . 8.7 tt -73.95 -40.51 63.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 1.33 110.26 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.788 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.9 tp -62.97 -29.73 47.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.651 -0.499 . . . . 0.44 109.651 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.656 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.37 -34.74 63.42 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.403 0.62 . . . . 0.21 110.285 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.9 ttm180 -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.556 -0.747 . . . . 1.48 111.125 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.67 ' O ' HG12 ' A' ' 34' ' ' ILE . 19.9 t -53.22 -46.37 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 N-CA-C 109.114 -0.698 . . . . 1.1 109.114 176.712 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.656 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -52.84 -50.33 43.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.153 -1.385 . . . . 0.22 111.337 175.374 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 -61.02 -49.7 76.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.733 -0.667 . . . . 3.75 111.627 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.581 HD12 HG12 ' A' ' 88' ' ' ILE . 35.8 mt -73.89 -51.94 22.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.713 0.634 . . . . 0.8 112.713 -171.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 30' ' ' VAL . 28.8 pt -83.81 -28.68 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.058 -0.657 . . . . 0.4 111.328 -176.142 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.97 149.8 8.64 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.596 -0.811 . . . . 0.26 111.66 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.809 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 1.6 p-10 -60.32 -41.34 93.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.078 0.399 . . . . 0.91 112.078 -177.33 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -71.79 -34.81 69.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.005 0.431 . . . . 3.19 110.237 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.849 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 21.5 mtpp -69.69 -25.03 63.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.122 -0.49 . . . . 2.45 110.992 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.64 -36.42 80.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.199 0.523 . . . . 0.29 109.606 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.41 -40.78 64.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.588 -0.733 . . . . 1.13 111.441 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.849 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 12.8 pt-20 -67.17 -31.81 72.48 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.726 -0.39 . . . . 2.1 110.443 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.823 ' HB3' HD13 ' A' ' 73' ' ' LEU . 28.6 mt -69.39 -41.91 75.84 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.349 -0.612 . . . . 0.29 109.349 171.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.62 -32.85 65.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.811 -0.631 . . . . 1.36 111.808 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 80.1 mtp -75.31 -42.36 54.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.136 0.493 . . . . 2.2 110.353 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -70.23 -25.05 63.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.799 -0.637 . . . . 1.83 111.369 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.566 HG23 HD11 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -56.04 -36.73 68.34 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 110.087 -0.338 . . . . 1.03 110.087 178.505 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.54 -34.4 77.83 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.075 -0.511 . . . . 0.88 110.975 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.639 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 43.9 mt-10 -71.12 -42.82 68.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.925 -0.58 . . . . 2.51 110.059 178.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.63 -33.39 63.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.013 -0.54 . . . . 0.76 109.813 176.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 3.7 tm-20 -61.66 -51.25 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.489 -0.778 . . . . 1.96 109.662 175.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.639 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.8 pt20 -64.84 -18.0 64.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.861 0.362 . . . . 2.25 111.3 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -99.06 -7.88 26.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.546 -0.297 . . . . 2.34 111.696 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.24 35.55 91.72 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 121.176 -0.535 . . . . 1.33 112.81 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -97.16 109.27 3.81 Favored Glycine 0 C--O 1.226 -0.358 0 C-N-CA 120.598 -0.81 . . . . 0.89 113.785 -174.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.914 HD11 HG23 ' A' ' 57' ' ' ILE . 2.6 tm? -176.82 124.47 0.15 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.122 0.487 . . . . 1.38 110.836 169.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.457 ' N ' HD22 ' A' ' 55' ' ' LEU . 97.2 m-85 -126.0 100.89 6.55 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.132 -1.062 . . . . 2.87 108.132 164.748 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.914 HG23 HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -72.03 -176.15 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.012 0.375 . . . . 0.68 112.012 -176.687 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -41.22 -45.61 2.92 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.912 -1.04 . . . . 0.91 112.573 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.707 ' ND2' ' HB2' ' A' ' 61' ' ' SER . 21.5 p-10 -94.92 -34.88 12.24 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.551 0.575 . . . . 2.28 112.551 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.75 -17.08 32.77 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.422 -0.418 . . . . 1.21 113.181 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.707 ' HB2' ' ND2' ' A' ' 59' ' ' ASN . 68.6 m -64.12 -57.61 9.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.689 0.281 . . . . 2.18 111.683 -178.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.552 ' O ' HD11 ' A' ' 57' ' ' ILE . 68.7 ttt180 -81.59 81.55 7.63 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.907 -0.775 . . . . 2.89 108.907 174.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -71.41 126.96 31.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.774 -0.648 . . . . 3.59 111.167 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.752 ' HD2' HG22 ' A' ' 69' ' ' VAL . 0.1 OUTLIER 70.08 58.0 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.703 1.001 . . . . 1.98 113.703 172.618 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.763 HG23 ' HA3' ' A' ' 68' ' ' GLY . 3.7 t -78.64 143.33 62.95 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.221 -0.9 . . . . 0.44 109.152 169.323 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.433 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.3 Cg_endo -46.25 -59.61 1.15 Allowed 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 124.134 3.222 . . . . 0.44 113.477 -174.843 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.589 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -68.25 -34.55 80.74 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.329 -0.939 . . . . 0.25 111.316 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.763 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.31 -38.65 79.58 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 114.981 -0.61 . . . . 0.3 112.114 177.199 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.752 HG22 ' HD2' ' A' ' 64' ' ' ARG . 22.0 t -59.67 -41.44 85.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.129 0.49 . . . . 0.74 110.204 178.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.63 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 21.1 t80 -65.73 -36.83 84.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.26 110.484 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -57.63 -36.77 72.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.755 -0.831 . . . . 0.32 108.755 176.819 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.882 ' HB2' HD23 ' A' ' 55' ' ' LEU . 66.5 t30 -63.05 -27.7 69.59 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.453 -0.794 . . . . 1.08 110.549 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.823 HD13 ' HB3' ' A' ' 42' ' ' LEU . 45.5 mt -58.22 -35.41 71.63 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.148 -0.478 . . . . 0.46 111.763 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.861 ' HB3' HG23 ' A' ' 85' ' ' ILE . 7.2 mp -64.4 -19.78 65.72 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.089 -0.505 . . . . 1.08 110.616 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.401 ' N ' ' HE2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -82.66 -40.11 21.16 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.927 0.394 . . . . 1.93 110.151 175.655 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -89.04 11.19 19.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.775 -0.648 . . . . 2.12 110.872 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.578 HG21 ' HB ' ' A' ' 80' ' ' ILE . 14.7 t -64.28 131.79 95.14 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 121.752 0.787 . . . . 0.94 109.946 -177.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.508 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.5 Cg_exo -72.72 -47.5 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.284 2.656 . . . . 1.0 113.851 -169.334 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.2 m -113.53 16.76 18.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.499 0.926 . . . . 1.49 113.499 -172.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.578 ' HB ' HG21 ' A' ' 77' ' ' THR . 61.4 mt -119.1 138.92 48.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.57 -0.452 . . . . 1.21 111.172 -174.739 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.3 p -98.28 167.2 11.0 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.063 0.458 . . . . 1.79 111.861 -177.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.455 ' H ' ' CD ' ' A' ' 82' ' ' GLU . 1.6 mp0 -51.9 -48.64 64.04 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.14 1.163 . . . . 2.89 114.14 -167.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -68.07 -37.09 80.86 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.567 -0.453 . . . . 2.06 111.796 -173.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.493 ' O ' HG13 ' A' ' 88' ' ' ILE . 43.1 mt-30 -62.22 -37.19 84.41 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.542 0.687 . . . . 2.31 109.26 175.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.861 HG23 ' HB3' ' A' ' 74' ' ' LEU . 82.4 mt -68.39 -49.49 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 114.637 -1.165 . . . . 1.41 110.934 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.546 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 39.3 ttmt -57.25 -41.45 79.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.887 -0.597 . . . . 2.45 111.538 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASP . . . . . 0.408 ' HA ' ' CD1' ' A' ' 91' ' ' ILE . 27.5 t70 -60.11 -32.92 71.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.005 0.431 . . . . 1.7 111.161 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.581 HG12 HD12 ' A' ' 33' ' ' ILE . 51.8 mt -70.83 -70.84 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.941 -0.572 . . . . 0.42 112.318 -177.169 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.903 ' HA ' HD11 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -106.89 -12.9 15.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 113.254 0.835 . . . . 0.75 113.254 -164.585 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.546 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 76.3 t80 -90.28 -38.14 13.6 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.793 0.33 . . . . 1.13 110.911 -172.809 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.408 ' CD1' ' HA ' ' A' ' 87' ' ' ASP . 51.4 mt . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 116.426 -0.352 . . . . 0.86 110.423 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.325 -0.62 . . . . 1.79 109.325 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.475 ' O ' HG23 ' A' ' 11' ' ' VAL . 39.1 t -63.31 119.23 9.25 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.648 -0.501 . . . . 1.33 109.648 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.839 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 63.6 mt-30 -55.87 -29.89 60.66 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.346 0.498 . . . . 1.88 112.346 -173.635 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -65.38 -50.17 66.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.084 0.469 . . . . 2.17 110.287 176.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LYS . . . . . 0.566 ' HE3' ' HB3' ' A' ' 13' ' ' ASP . 0.3 OUTLIER -70.25 -37.45 74.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.918 -0.583 . . . . 2.55 109.885 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.676 ' O ' HG12 ' A' ' 15' ' ' ILE . 69.5 t -57.14 -47.62 83.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.228 -0.286 . . . . 0.39 110.228 177.579 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.23 -42.86 70.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.206 0.527 . . . . 0.35 111.029 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.566 ' HB3' ' HE3' ' A' ' 10' ' ' LYS . 35.8 t70 -70.37 -39.73 74.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.687 -0.688 . . . . 0.86 110.537 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 18' ' ' ARG . 7.6 tp10 -61.46 -45.2 95.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.118 -0.947 . . . . 2.05 111.292 -177.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.676 HG12 ' O ' ' A' ' 11' ' ' VAL . 5.2 mm -59.98 -52.17 64.33 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-O 121.067 0.461 . . . . 0.33 109.925 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.624 ' HB3' HG21 ' A' ' 27' ' ' ILE . 19.4 p -64.95 -38.88 92.45 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.642 -0.708 . . . . 0.32 111.32 -175.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -59.23 -45.61 90.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.783 -0.644 . . . . 0.59 110.949 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 14' ' ' GLU . 75.0 mtt180 -79.04 -33.7 44.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.603 -0.272 . . . . 2.83 111.529 -177.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.941 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.2 mm? -79.29 -9.4 59.57 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.445 0.535 . . . . 0.99 112.445 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 58.57 34.65 24.03 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 108.079 -1.082 . . . . 1.6 108.079 -171.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.524 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 1.3 tm-20 -71.8 126.07 91.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 114.089 -1.414 . . . . 1.31 111.91 -165.871 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.46 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 73.6 Cg_endo -69.93 -46.65 1.08 Allowed 'Trans proline' 0 N--CA 1.476 0.463 0 C-N-CA 124.657 3.571 . . . . 0.41 114.345 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.46 ' HG2' ' HG2' ' A' ' 22' ' ' PRO . 33.0 pttt -109.85 66.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.382 0.611 . . . . 1.41 110.494 -169.012 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.551 ' HA ' HG22 ' A' ' 27' ' ' ILE . 83.6 mttt -59.32 -12.44 5.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.523 -1.217 . . . . 1.75 113.411 -167.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.13 -46.61 86.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.374 0.607 . . . . 2.14 109.662 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.61 HD11 ' HA ' ' A' ' 89' ' ' PHE . 6.6 tt -73.36 -41.57 63.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.289 -0.868 . . . . 1.33 110.812 -177.065 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.624 HG21 ' HB3' ' A' ' 16' ' ' SER . 6.4 tp -65.87 -30.04 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 121.004 0.43 . . . . 0.44 110.413 -177.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.703 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.18 -33.82 63.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.579 0.704 . . . . 0.21 110.333 173.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 33' ' ' ILE . 38.7 ttm180 -63.03 -39.15 93.89 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.296 -0.865 . . . . 1.48 111.763 -179.141 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.662 HG21 ' HE1' ' A' ' 70' ' ' PHE . 23.1 t -52.78 -43.16 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.128 -0.693 . . . . 1.1 109.128 177.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.703 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.0 t -53.18 -50.07 48.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.278 -1.328 . . . . 0.22 110.855 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -59.49 -43.82 93.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.22 -0.9 . . . . 3.75 111.429 -177.211 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.778 HG13 HG12 ' A' ' 88' ' ' ILE . 38.9 mm -75.55 -49.73 26.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.672 . . . . 0.8 112.5 -173.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 30' ' ' VAL . 36.4 pt -94.76 -29.07 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.604 0.594 . . . . 0.4 112.604 -172.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.33 162.17 10.81 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.556 -0.83 . . . . 0.26 112.673 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.839 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 20.4 p-10 -67.59 -55.99 11.21 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.515 0.326 . . . . 0.91 111.667 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.56 -33.85 69.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.869 -0.419 . . . . 3.19 109.869 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 5.9 mmmm -56.83 -38.3 72.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.855 -0.611 . . . . 2.45 110.914 176.23 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.451 ' O ' HD22 ' A' ' 43' ' ' LEU . . . -71.42 -38.85 71.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.29 110.869 177.502 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.805 ' HA ' HD23 ' A' ' 43' ' ' LEU . 22.3 mt -71.42 -33.26 49.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.45 -0.341 . . . . 1.13 111.308 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.46 -33.76 74.3 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.995 0.426 . . . . 2.1 110.179 173.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.839 HD22 ' HB3' ' A' ' 73' ' ' LEU . 79.0 mt -62.73 -36.7 83.84 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.914 -0.585 . . . . 0.29 110.47 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.805 HD23 ' HA ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -57.47 -32.73 67.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.575 0.226 . . . . 1.36 111.036 178.222 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 78.7 mmm -71.41 -39.52 71.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.993 0.425 . . . . 2.2 110.544 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.88 -24.46 62.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.129 -0.487 . . . . 1.83 111.886 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.601 HG22 HD11 ' A' ' 73' ' ' LEU . 43.1 p -54.47 -42.36 70.6 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.55 -0.46 . . . . 1.03 109.877 175.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.25 -39.99 76.72 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.107 -0.497 . . . . 0.88 111.032 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.86 -46.91 85.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.629 -0.714 . . . . 2.51 110.655 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 47.5 t -76.4 -32.08 21.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.339 -0.392 . . . . 0.76 111.263 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.883 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 22.2 mt-10 -67.35 -38.94 85.63 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.913 0.338 . . . . 1.96 111.913 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.07 -19.05 62.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.852 0.358 . . . . 2.25 111.224 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -106.31 -25.06 12.1 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.286 -0.415 . . . . 2.34 112.088 -176.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.86 50.21 9.23 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 116.007 -0.542 . . . . 1.33 113.6 174.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -109.7 118.43 5.13 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.123 -1.036 . . . . 0.89 114.606 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.729 ' HB3' ' HA ' ' A' ' 64' ' ' ARG . 46.6 tp -177.97 131.63 0.15 Allowed 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.471 0.545 . . . . 1.38 112.471 168.26 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -124.65 101.52 7.16 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.107 -1.071 . . . . 2.87 108.107 165.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.543 HD11 ' C ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -68.85 -167.23 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 113.595 0.961 . . . . 0.68 113.595 -169.422 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -41.58 -48.01 3.94 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.534 -1.212 . . . . 0.91 111.52 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -116.02 -37.01 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.41 . . . . 2.28 111.008 173.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.507 ' HA2' HG13 ' A' ' 57' ' ' ILE . . . 98.69 8.02 54.91 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.23 -0.986 . . . . 1.21 111.354 -171.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 5.3 p -54.66 -53.7 51.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.319 0.58 . . . . 2.18 110.867 -178.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.543 ' C ' HD11 ' A' ' 57' ' ' ILE . 5.0 ptp180 -112.12 53.58 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.6 -0.889 . . . . 2.89 108.6 171.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ARG . . . . . 0.458 ' HA ' ' CG1' ' A' ' 57' ' ' ILE . 14.9 ptp180 -50.36 132.42 24.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.786 -1.097 . . . . 3.59 112.211 -168.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.883 ' NH2' ' HA ' ' A' ' 50' ' ' GLU . 19.3 tpt85 68.26 44.82 1.32 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.992 0.901 . . . . 1.98 111.251 174.688 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.698 ' O ' HG23 ' A' ' 69' ' ' VAL . 4.7 t -74.14 144.01 81.25 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.891 -1.049 . . . . 0.44 110.176 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -46.27 -59.54 1.18 Allowed 'Trans proline' 0 N--CA 1.485 1.016 0 C-N-CA 124.365 3.377 . . . . 0.44 113.883 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.941 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -66.97 -35.3 89.25 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.267 -0.968 . . . . 0.25 111.115 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.648 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -58.33 -32.61 68.37 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.821 -0.689 . . . . 0.3 112.227 176.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.824 HG22 ' HD2' ' A' ' 64' ' ' ARG . 17.1 t -63.71 -35.04 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 CA-C-O 121.223 0.535 . . . . 0.74 110.561 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.662 ' HE1' HG21 ' A' ' 30' ' ' VAL . 14.5 t80 -65.29 -35.6 81.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.887 -0.597 . . . . 0.26 109.813 174.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.532 ' N ' HD23 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -60.21 -34.8 74.15 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.961 -1.125 . . . . 0.32 107.961 177.228 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.685 ' HB2' HD13 ' A' ' 55' ' ' LEU . 54.1 t30 -63.08 -27.13 69.18 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.326 -0.852 . . . . 1.08 110.072 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.839 ' HB3' HD22 ' A' ' 42' ' ' LEU . 67.7 mt -61.05 -33.4 73.24 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.834 -0.621 . . . . 0.46 111.253 175.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.763 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.4 mp -63.98 -20.38 65.85 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.143 -0.48 . . . . 1.08 109.983 175.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.823 ' HZ1' HG21 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -85.11 -45.26 12.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.363 0.602 . . . . 1.93 109.837 172.046 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -81.58 9.11 8.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.133 -0.94 . . . . 2.12 111.379 -176.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.622 ' CG2' ' HB ' ' A' ' 80' ' ' ILE . 9.9 t -68.47 122.47 84.64 Favored Pre-proline 0 N--CA 1.446 -0.668 0 N-CA-C 108.899 -0.778 . . . . 0.94 108.899 176.111 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 21.1 Cg_exo -65.87 -39.33 20.12 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.839 2.36 . . . . 1.0 113.629 -164.227 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 19.5 m -113.23 5.66 17.07 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.298 0.851 . . . . 1.49 113.298 -175.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.622 ' HB ' ' CG2' ' A' ' 77' ' ' THR . 62.7 mt -113.24 138.94 41.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 121.862 -0.524 . . . . 1.21 111.283 -174.216 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.2 p -97.12 155.15 16.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.436 0.636 . . . . 1.79 111.656 -177.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 57.3 mm-40 -59.37 -27.03 65.59 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.076 1.139 . . . . 2.89 114.076 -171.234 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.85 -43.92 86.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.676 0.671 . . . . 2.06 110.916 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLN . . . . . 0.453 ' O ' HG13 ' A' ' 88' ' ' ILE . 75.6 mm-40 -67.36 -26.52 66.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.79 0.805 . . . . 2.31 109.157 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.823 HG21 ' HZ1' ' A' ' 75' ' ' LYS . 51.1 mm -75.9 -38.92 37.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.464 -1.244 . . . . 1.41 112.113 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 82' ' ' GLU . 8.0 mttm -57.7 -43.29 85.07 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 108.71 -0.848 . . . . 2.45 108.71 177.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -59.32 -32.89 70.49 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.885 -1.507 . . . . 1.7 109.862 -175.105 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.778 HG12 HG13 ' A' ' 33' ' ' ILE . 49.1 mt -71.94 -64.94 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.995 -1.002 . . . . 0.42 112.22 178.141 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.722 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -108.32 -19.05 13.6 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 114.77 1.396 . . . . 0.75 114.77 -167.368 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.722 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 89.3 t80 -76.88 -34.11 57.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.396 0.543 . . . . 1.13 110.454 -174.133 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.6 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.054 -0.521 . . . . 0.86 110.325 178.423 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 121.933 0.873 . . . . 1.79 109.303 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -73.94 139.6 45.01 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.783 -0.821 . . . . 1.33 108.783 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.614 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 61.2 mt-30 -48.54 -45.77 37.9 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.974 0.731 . . . . 1.88 112.974 -169.173 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -63.67 -42.76 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 2.17 110.706 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -70.39 -37.13 74.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.04 0.448 . . . . 2.55 110.044 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.704 HG13 HD11 ' A' ' 15' ' ' ILE . 49.3 t -56.66 -51.91 60.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.634 -0.712 . . . . 0.39 110.865 177.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.18 -33.94 59.31 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.156 0.503 . . . . 0.35 111.206 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -70.38 -41.66 72.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.824 -0.625 . . . . 0.86 110.789 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -72.89 -42.63 63.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.372 -0.376 . . . . 2.05 111.597 -175.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.865 HD12 HD21 ' A' ' 43' ' ' LEU . 1.3 mm -58.68 -48.04 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 120.34 -0.544 . . . . 0.33 110.209 -177.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.666 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 21.7 p -64.57 -34.61 78.67 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.667 -0.697 . . . . 0.32 110.899 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -68.49 -44.06 75.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.196 -0.457 . . . . 0.59 110.481 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -69.46 -46.28 67.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.906 -0.588 . . . . 2.83 111.72 -176.629 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.842 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.2 mm? -85.1 1.43 47.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.087 0.402 . . . . 0.99 112.087 -175.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 55.68 33.17 20.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.241 0.543 . . . . 1.6 109.561 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.694 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.08 116.77 18.77 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 114.623 -1.171 . . . . 1.31 112.694 -168.031 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.472 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 52.5 Cg_endo -63.45 -40.26 32.15 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 124.011 3.141 . . . . 0.41 113.33 172.326 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.504 ' HG3' ' OE1' ' A' ' 21' ' ' GLU . 41.9 pttt -109.0 68.56 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.824 0.821 . . . . 1.41 109.463 -172.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.679 ' HA ' HG22 ' A' ' 27' ' ' ILE . 50.4 mttp -62.77 -12.56 24.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.68 -1.146 . . . . 1.75 113.542 -166.54 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -75.42 -33.85 60.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.117 0.484 . . . . 2.14 110.115 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.63 HD11 ' HA ' ' A' ' 89' ' ' PHE . 0.6 OUTLIER -73.57 -47.33 41.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 1.33 110.171 -178.548 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.694 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 11.0 tp -62.97 -29.43 47.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.216 -0.447 . . . . 0.44 110.895 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.658 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.94 -33.42 63.91 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.061 0.457 . . . . 0.21 110.673 174.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 88' ' ' ILE . 14.0 ttm180 -58.15 -40.15 80.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.032 -0.531 . . . . 1.48 110.874 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.539 HG21 ' HE1' ' A' ' 70' ' ' PHE . 23.3 t -53.06 -44.7 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.487 0.66 . . . . 1.1 109.535 177.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.658 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 82.0 t -52.95 -50.37 44.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 114.19 -1.368 . . . . 0.22 111.149 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -66.07 -41.92 90.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.298 -0.865 . . . . 3.75 111.14 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.493 HG13 HG12 ' A' ' 88' ' ' ILE . 50.1 mm -74.67 -50.27 26.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.897 -0.592 . . . . 0.8 112.541 -172.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.527 HG12 ' O ' ' A' ' 30' ' ' VAL . 33.1 pt -95.56 -29.49 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.106 -0.638 . . . . 0.4 111.902 -174.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.33 160.81 10.98 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.401 -0.904 . . . . 0.26 112.651 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.614 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 3.0 p-10 -67.84 -48.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.49 0.186 . . . . 0.91 111.409 -177.571 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.412 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 19.4 ptmt -71.73 -33.09 68.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.067 0.461 . . . . 3.19 109.876 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -64.31 -32.2 73.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.016 -0.538 . . . . 2.45 109.844 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.24 -42.52 75.53 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.869 -0.605 . . . . 0.29 109.991 173.037 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.772 ' HA ' ' HG ' ' A' ' 43' ' ' LEU . 44.8 mm -59.96 -37.68 73.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 120.921 0.391 . . . . 1.13 110.672 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 14.4 mm-40 -54.33 -46.45 72.9 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.236 -0.653 . . . . 2.1 109.236 173.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.944 HD22 ' HB3' ' A' ' 73' ' ' LEU . 72.2 mt -65.63 -43.18 90.29 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.268 -0.878 . . . . 0.29 111.279 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.865 HD21 HD12 ' A' ' 15' ' ' ILE . 4.8 mt -56.68 -38.74 72.65 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.024 0.44 . . . . 1.36 110.334 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 tpp -74.69 -39.78 61.77 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.215 -0.448 . . . . 2.2 109.926 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 40.6 mt-10 -70.01 -23.69 63.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.721 -0.672 . . . . 1.83 112.172 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.54 HG23 ' O ' ' A' ' 42' ' ' LEU . 71.6 p -51.1 -49.11 61.35 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.715 0.293 . . . . 1.03 110.25 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.62 82.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.724 -0.671 . . . . 0.88 111.481 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 36.6 mt-10 -66.94 -40.22 87.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.153 0.502 . . . . 2.51 110.389 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -76.85 -33.51 21.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.065 -0.516 . . . . 0.76 110.495 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 46' ' ' THR . 40.5 mt-10 -58.44 -51.47 69.71 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.344 -0.389 . . . . 1.96 111.27 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 5.3 pp0? -63.72 -22.76 67.07 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 123.371 0.419 . . . . 2.25 111.085 -176.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -89.47 -12.65 39.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.341 0.591 . . . . 2.34 110.394 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.45 28.93 64.75 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.673 -0.694 . . . . 1.33 112.488 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.422 ' O ' ' HB2' ' A' ' 55' ' ' LEU . . . -89.48 101.27 2.75 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.678 -0.772 . . . . 0.89 113.889 -174.018 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 1.11 HD11 HG23 ' A' ' 57' ' ' ILE . 2.7 tm? -176.62 124.57 0.17 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.102 0.477 . . . . 1.38 111.268 170.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -124.6 105.03 9.04 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.24 -1.022 . . . . 2.87 108.24 164.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.11 HG23 HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -77.5 -179.45 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 112.583 0.586 . . . . 0.68 112.583 -171.02 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.47 -43.93 65.28 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.778 -0.646 . . . . 0.91 111.481 -176.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -90.49 -37.54 13.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 2.28 110.989 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 83.75 -14.87 39.83 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.163 -0.541 . . . . 1.21 112.703 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -57.78 11.51 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.892 0.377 . . . . 2.18 111.253 -176.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -96.41 55.69 1.5 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.536 0.684 . . . . 2.89 109.605 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.5 ptt180 -53.89 146.36 14.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.127 -0.942 . . . . 3.59 111.795 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.643 ' H ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER 61.95 49.83 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.629 -1.169 . . . . 1.98 112.621 -177.815 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.864 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.8 t -75.51 142.01 73.78 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.256 -0.883 . . . . 0.44 109.457 169.437 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -47.31 -59.12 1.37 Allowed 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 123.831 3.021 . . . . 0.44 112.808 -175.533 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.842 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -62.65 -39.19 97.59 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.018 -0.833 . . . . 0.25 111.018 177.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.864 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.79 -31.97 61.44 Favored Glycine 0 N--CA 1.447 -0.579 0 CA-C-N 114.866 -0.667 . . . . 0.3 112.868 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 65' ' ' THR . 11.0 t -66.13 -38.33 81.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.124 0.487 . . . . 0.74 109.891 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.539 ' HE1' HG21 ' A' ' 30' ' ' VAL . 5.9 t80 -66.41 -38.69 88.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.162 -0.472 . . . . 0.26 109.932 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -57.0 -34.52 68.23 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.83 -0.804 . . . . 0.32 108.83 176.19 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.831 ' HB2' HD23 ' A' ' 55' ' ' LEU . 6.0 t30 -59.59 -38.94 82.56 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.559 -0.746 . . . . 1.08 110.154 176.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.944 ' HB3' HD22 ' A' ' 42' ' ' LEU . 70.9 mt -58.35 -35.06 71.37 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.55 -0.75 . . . . 0.46 112.084 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.594 ' HB3' HG23 ' A' ' 85' ' ' ILE . 14.7 mt -57.54 -47.02 83.14 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.326 -0.397 . . . . 1.08 110.961 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LYS . . . . . 0.645 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.1 OUTLIER -93.03 -7.75 44.86 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.142 -0.623 . . . . 1.93 111.808 -179.091 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -98.82 -18.0 18.17 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.221 -0.445 . . . . 2.12 111.013 -178.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.535 HG21 HD12 ' A' ' 80' ' ' ILE . 10.1 t -58.6 126.22 78.93 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.698 0.761 . . . . 0.94 110.973 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.2 Cg_exo -73.91 -25.75 13.93 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 123.31 2.674 . . . . 1.0 113.282 -171.219 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.0 t -101.35 -2.54 30.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.175 0.435 . . . . 1.49 112.175 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.535 HD12 HG21 ' A' ' 77' ' ' THR . 36.2 mt -119.29 136.87 55.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 121.931 -0.481 . . . . 1.21 110.911 -176.524 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -85.25 153.87 22.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.182 0.515 . . . . 1.79 110.578 -176.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.86 -30.35 71.45 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.306 -0.861 . . . . 2.89 112.942 -167.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.41 -36.88 79.74 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.94 -0.304 . . . . 2.06 111.437 -176.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -66.2 -36.08 82.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.61 0.719 . . . . 2.31 109.536 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 74' ' ' LEU . 45.8 mm -74.97 -36.62 39.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.878 -1.056 . . . . 1.41 111.629 -177.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.537 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 23.0 ttmm -51.55 -39.22 57.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 2.45 111.49 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -71.41 -33.1 69.14 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.053 -0.521 . . . . 1.7 111.498 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.501 HG21 HG22 ' A' ' 30' ' ' VAL . 57.7 mt -65.96 -67.7 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 112.569 0.581 . . . . 0.42 112.569 -170.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.826 ' H ' ' HD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -112.05 -27.56 8.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.466 0.543 . . . . 0.75 112.466 -170.596 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.537 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.7 t80 -67.35 -36.35 81.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.109 0.481 . . . . 1.13 111.233 -172.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.6 mt . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 0.86 110.279 177.39 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 121.677 0.751 . . . . 1.79 110.41 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.454 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.8 m -64.94 130.92 45.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.596 -0.729 . . . . 1.33 110.289 177.1 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.776 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.7 mt-30 -51.43 -47.05 63.13 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.905 0.705 . . . . 1.88 112.905 -167.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.61 -46.7 87.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.407 0.146 . . . . 2.17 110.956 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -58.72 -41.63 86.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.035 0.445 . . . . 2.55 109.962 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' VAL . . . . . 0.665 ' O ' HG12 ' A' ' 15' ' ' ILE . 78.3 t -60.03 -57.74 10.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.499 -0.773 . . . . 0.39 110.772 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.13 -38.23 70.54 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.291 0.567 . . . . 0.35 111.276 -176.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -39.29 89.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.434 -0.803 . . . . 0.86 110.665 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -76.71 -38.31 54.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.119 -0.491 . . . . 2.05 112.038 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.668 HG22 HD23 ' A' ' 19' ' ' LEU . 2.2 mm -61.28 -47.34 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 C-N-CA 120.376 -0.529 . . . . 0.33 110.036 -177.448 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' SER . . . . . 0.581 ' HB3' HG21 ' A' ' 27' ' ' ILE . 17.0 p -58.25 -38.51 77.04 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.944 -0.571 . . . . 0.32 110.791 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -68.69 -45.16 72.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 0.59 110.835 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -67.01 -43.38 83.02 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.238 0.458 . . . . 2.83 112.238 -175.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.668 HD23 HG22 ' A' ' 15' ' ' ILE . 3.6 mm? -79.41 -9.8 59.67 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.566 -0.454 . . . . 0.99 111.249 178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 53.59 31.23 12.15 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.531 -0.914 . . . . 1.6 108.531 -170.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.615 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 19.6 tt0 -69.34 130.13 91.18 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 114.124 -1.398 . . . . 1.31 112.073 -169.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 43.4 Cg_endo -64.41 -54.84 0.69 Allowed 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 124.352 3.368 . . . . 0.41 113.238 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HD2' ' HB3' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -85.61 67.89 10.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.918 0.866 . . . . 1.41 110.657 -176.848 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.475 ' O ' HG22 ' A' ' 27' ' ' ILE . 77.1 mttt -62.9 -19.69 64.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.518 -1.219 . . . . 1.75 112.143 -172.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.39 -41.62 85.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.195 0.521 . . . . 2.14 110.119 174.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.772 HD21 ' HA ' ' A' ' 89' ' ' PHE . 1.6 tm? -73.1 -42.93 62.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.431 -0.804 . . . . 1.33 110.811 -176.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ILE . . . . . 0.615 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 5.1 tp -61.32 -32.17 52.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.916 0.388 . . . . 0.44 110.375 -177.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ALA . . . . . 0.562 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.25 -35.15 61.44 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.235 -0.439 . . . . 0.21 110.881 174.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.2 ttm-85 -62.31 -41.12 98.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.34 -0.391 . . . . 1.48 111.21 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' VAL . . . . . 0.571 ' O ' HG12 ' A' ' 34' ' ' ILE . 28.8 t -53.83 -45.25 62.3 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.192 0 CA-C-O 121.307 0.575 . . . . 1.1 109.595 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.562 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.5 t -53.21 -51.69 37.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 114.503 -1.226 . . . . 0.22 110.748 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -59.67 -42.64 93.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 3.75 111.709 -177.108 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.445 HG13 HG12 ' A' ' 88' ' ' ILE . 45.1 mm -74.99 -53.03 17.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 112.882 0.697 . . . . 0.8 112.882 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ILE . . . . . 0.571 HG12 ' O ' ' A' ' 30' ' ' VAL . 29.8 pt -95.71 -7.63 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 112.192 0.441 . . . . 0.4 112.192 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.07 161.91 26.56 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.345 -0.931 . . . . 0.26 112.392 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . 0.776 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 13.8 p-10 -63.84 -42.31 97.63 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 122.377 0.271 . . . . 0.91 111.601 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 39.5 ttpt -67.33 -50.42 60.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.051 -0.26 . . . . 3.19 111.019 -175.396 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' LYS . . . . . 0.549 ' HB3' HD12 ' A' ' 34' ' ' ILE . 12.2 mmmt -61.47 -26.43 67.88 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.66 0.244 . . . . 2.45 111.66 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.483 ' O ' HD23 ' A' ' 43' ' ' LEU . . . -67.36 -47.66 69.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.01 -0.367 . . . . 0.29 110.01 176.07 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ILE . . . . . 0.653 ' HA ' HD21 ' A' ' 43' ' ' LEU . 49.4 mm -66.35 -38.15 81.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 120.986 0.422 . . . . 1.13 110.219 177.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 32.9 mm-40 -55.9 -38.89 70.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.814 -0.63 . . . . 2.1 110.051 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.687 HD22 ' HB3' ' A' ' 73' ' ' LEU . 22.0 mt -62.88 -43.42 98.85 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.161 -0.472 . . . . 0.29 112.093 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.653 HD21 ' HA ' ' A' ' 40' ' ' ILE . 0.1 OUTLIER -64.19 -28.58 69.84 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 119.579 -0.849 . . . . 1.36 111.094 178.895 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.2 mtp -73.9 -36.89 64.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.142 0.496 . . . . 2.2 110.002 170.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.3 mt-10 -65.77 -25.54 67.31 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.659 -0.7 . . . . 1.83 111.706 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' THR . . . . . 0.635 HG22 HD11 ' A' ' 73' ' ' LEU . 68.5 p -55.35 -40.0 70.72 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.868 0.366 . . . . 1.03 110.116 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.92 -32.86 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.88 110.859 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.473 ' HA ' ' HG3' ' A' ' 51' ' ' GLN . 29.1 mt-10 -71.41 -27.99 63.68 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.101 -0.5 . . . . 2.51 109.93 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 56.7 t -69.23 -43.25 81.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.118 0.485 . . . . 0.76 109.767 170.311 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 46' ' ' THR . 4.6 mm-40 -55.83 -42.99 76.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.42 -0.809 . . . . 1.96 110.44 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.473 ' HG3' ' HA ' ' A' ' 48' ' ' GLU . 5.3 pp0? -82.55 -19.02 39.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.106 -0.497 . . . . 2.25 111.686 -176.408 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -87.87 -26.7 22.63 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.271 0.471 . . . . 2.34 112.271 -171.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.95 -12.54 2.37 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 119.967 -1.111 . . . . 1.33 113.29 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.33 -133.18 10.95 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.093 -1.051 . . . . 0.89 114.81 171.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 1.072 HD11 HG23 ' A' ' 57' ' ' ILE . 0.6 OUTLIER -162.83 131.94 4.16 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.599 0.36 . . . . 1.38 110.895 -163.467 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PHE . . . . . 0.632 ' N ' HD22 ' A' ' 55' ' ' LEU . 34.6 t80 -116.74 110.55 18.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.269 -1.012 . . . . 2.87 108.269 168.716 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 1.072 HG23 HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -77.73 -178.41 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.375 0.88 . . . . 0.68 113.375 -170.444 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.92 -46.53 60.84 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 115.801 -0.636 . . . . 0.91 111.345 -177.206 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -92.8 -36.74 12.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.081 -0.509 . . . . 2.28 110.212 176.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLY . . . . . 0.486 ' H ' HG13 ' A' ' 57' ' ' ILE . . . 84.22 -19.69 16.81 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 114.598 0.599 . . . . 1.21 114.598 169.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.4 t -66.7 -45.61 78.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 117.377 0.589 . . . . 2.18 110.412 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.549 ' O ' HD11 ' A' ' 57' ' ' ILE . 20.0 ttt180 -85.48 42.09 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.699 0.761 . . . . 2.89 109.687 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -46.95 132.04 11.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.477 -1.238 . . . . 3.59 113.076 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.732 ' HD3' ' N ' ' A' ' 55' ' ' LEU . 19.2 mmm180 68.42 57.97 0.44 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.754 -1.112 . . . . 1.98 112.238 175.142 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' THR . . . . . 0.667 HG23 ' HA3' ' A' ' 68' ' ' GLY . 5.3 t -82.73 144.69 49.02 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 114.779 -1.1 . . . . 0.44 108.19 169.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PRO . . . . . 0.561 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.45 -60.35 0.9 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 123.825 3.017 . . . . 0.44 113.746 -173.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.696 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -65.25 -37.22 93.74 Favored Glycine 0 C--O 1.224 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.25 111.163 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.667 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.37 -32.88 61.07 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.123 -0.539 . . . . 0.3 112.705 178.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 65' ' ' THR . 48.3 t -62.6 -40.69 89.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.226 0.536 . . . . 0.74 109.729 176.318 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PHE . . . . . 0.543 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 12.5 t80 -65.24 -36.99 85.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.53 -0.759 . . . . 0.26 109.993 174.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.696 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -57.54 -43.53 84.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.177 -1.046 . . . . 0.32 108.177 177.779 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ASN . . . . . 0.497 ' HB2' HD23 ' A' ' 55' ' ' LEU . 60.4 t30 -55.93 -26.42 47.72 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.73 0.643 . . . . 1.08 110.924 -178.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.687 ' HB3' HD22 ' A' ' 42' ' ' LEU . 77.0 mt -56.39 -41.59 76.54 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.024 -0.535 . . . . 0.46 111.297 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.877 ' HB3' HG23 ' A' ' 85' ' ' ILE . 6.5 mp -62.47 -19.02 63.12 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.014 0.435 . . . . 1.08 110.784 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -91.62 -23.37 19.88 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.729 0.27 . . . . 1.93 111.729 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -114.64 -11.99 12.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.675 0.274 . . . . 2.12 111.446 -173.515 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' THR . . . . . 0.749 HG21 HD12 ' A' ' 80' ' ' ILE . 5.5 t -60.24 132.75 90.35 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 121.661 0.743 . . . . 0.94 111.281 -172.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 3.4 Cg_exo -74.3 -36.97 2.8 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 123.536 2.824 . . . . 1.0 114.676 -167.246 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 39.6 m -111.88 17.59 19.62 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.135 1.161 . . . . 1.49 114.135 -168.437 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.749 HD12 HG21 ' A' ' 77' ' ' THR . 44.0 mt -115.2 134.03 59.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 118.289 0.495 . . . . 1.21 110.523 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 41.2 m -75.9 143.98 41.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.651 0.739 . . . . 1.79 111.562 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.424 ' HA ' HD12 ' A' ' 85' ' ' ILE . 42.8 tt0 -52.58 -45.38 66.44 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.061 -1.427 . . . . 2.89 113.632 -168.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.82 -42.12 77.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.944 -0.302 . . . . 2.06 110.919 -177.826 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.32 -31.71 69.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.46 0.647 . . . . 2.31 110.001 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ILE . . . . . 0.877 HG23 ' HB3' ' A' ' 74' ' ' LEU . 97.3 mt -66.86 -45.85 86.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.776 -1.102 . . . . 1.41 111.404 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 14.0 ttmm -56.27 -39.52 72.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.889 -0.596 . . . . 2.45 111.083 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -66.65 -31.69 72.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.562 -0.745 . . . . 1.7 112.622 -173.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ILE . . . . . 0.445 HG12 HG13 ' A' ' 33' ' ' ILE . 43.3 mt -69.87 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.359 0.503 . . . . 0.42 112.359 -173.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.772 ' HA ' HD21 ' A' ' 26' ' ' LEU . 9.9 p90 -95.59 -20.98 18.54 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.634 0.605 . . . . 0.75 112.634 -164.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 90.7 t80 -93.77 -10.38 34.37 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.298 -0.41 . . . . 1.13 111.865 -165.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt . . . . . 0 C--N 1.325 -0.495 0 C-N-CA 120.686 -0.405 . . . . 0.86 111.768 -176.866 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 N-CA-C 111.907 -0.477 . . . . 9.19 111.907 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.67 -53.49 0.77 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.897 0.38 . . . . 7.69 110.963 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 48.2 tpp -111.56 -59.88 1.92 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.087 0.47 . . . . 7.18 110.551 -177.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.424 ' H ' ' H ' ' A' ' 5' ' ' GLU . . . -168.5 -22.07 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.609 -0.723 . . . . 4.5 109.701 -178.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.424 ' H ' ' H ' ' A' ' 4' ' ' ALA . 2.9 mm-40 64.09 37.55 9.01 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 114.125 -1.398 . . . . 4.1 109.977 174.077 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.776 ' HB3' HD12 ' A' ' 40' ' ' ILE . 0.5 OUTLIER -74.58 62.7 1.05 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.21 -0.905 . . . . 1.79 112.571 -175.371 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.467 ' O ' HG23 ' A' ' 11' ' ' VAL . 28.5 t -74.93 121.8 22.46 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.141 -1.059 . . . . 1.33 108.141 170.048 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 36' ' ' ASN . 0.2 OUTLIER -56.64 -29.91 62.74 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.417 0.525 . . . . 1.88 112.417 -169.533 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.68 -47.96 70.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.907 0.384 . . . . 2.17 110.143 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -63.31 -40.49 97.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.887 -0.597 . . . . 2.55 110.25 175.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.657 ' O ' HG12 ' A' ' 15' ' ' ILE . 93.1 t -57.44 -54.56 29.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 0.39 110.606 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -40.09 75.86 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.954 0.407 . . . . 0.35 111.576 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.71 -32.83 73.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.944 -0.571 . . . . 0.86 110.519 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -71.8 -48.15 48.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.739 -0.664 . . . . 2.05 111.013 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 11' ' ' VAL . 1.2 mm -58.38 -50.89 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-O 121.277 0.561 . . . . 0.33 110.012 -178.18 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.557 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 12.7 p -59.08 -37.23 76.59 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.425 -0.807 . . . . 0.32 111.576 -175.092 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.71 -44.95 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.442 -0.344 . . . . 0.59 110.897 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.7 mtp85 -72.42 -29.47 63.74 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.507 0.558 . . . . 2.83 112.507 -173.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.633 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 3.8 mm? -93.97 0.04 55.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.758 0.313 . . . . 0.99 111.292 178.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 50.47 44.82 26.92 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 115.285 -0.871 . . . . 1.6 109.14 -173.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.842 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -61.26 120.15 52.37 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 114.523 -1.217 . . . . 1.31 112.427 -170.514 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 55.4 Cg_endo -64.46 -39.63 27.8 Favored 'Trans proline' 0 CA--C 1.529 0.273 0 C-N-CA 124.28 3.32 . . . . 0.41 113.084 174.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.544 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 35.2 pttt -120.45 63.8 0.84 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.195 0.522 . . . . 1.41 109.948 -172.063 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -56.25 -17.6 8.02 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.315 1.228 . . . . 1.75 114.315 -164.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.16 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 2.14 110.029 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.856 HD11 ' HB3' ' A' ' 89' ' ' PHE . 2.2 tm? -73.16 -51.57 17.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.573 -0.739 . . . . 1.33 110.387 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.842 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 7.3 tp -62.36 -32.29 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 116.231 -0.44 . . . . 0.44 111.03 -177.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.739 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -72.9 -33.0 65.74 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.56 0.695 . . . . 0.21 110.078 174.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.485 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 33.3 ttm180 -63.35 -40.92 98.61 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.23 -0.896 . . . . 1.48 111.908 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.67 ' HA ' HD13 ' A' ' 88' ' ' ILE . 33.0 t -53.19 -45.07 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 N-CA-C 108.781 -0.822 . . . . 1.1 108.781 177.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.739 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -53.02 -55.75 10.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.009 -1.45 . . . . 0.22 111.478 174.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -59.53 -40.14 86.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.608 -0.724 . . . . 3.75 111.304 -177.159 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.65 HG13 HG12 ' A' ' 88' ' ' ILE . 47.0 mm -75.3 -53.11 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.802 0.668 . . . . 0.8 112.802 -176.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.641 HG12 ' O ' ' A' ' 30' ' ' VAL . 28.3 pt -88.06 -29.28 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 C-N-CA 120.061 -0.656 . . . . 0.4 112.248 -171.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.54 156.2 8.54 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.33 -0.938 . . . . 0.26 112.644 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 8' ' ' GLN . 14.1 p-10 -62.25 -52.02 65.39 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.402 0.281 . . . . 0.91 111.568 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 84.8 tttt -71.74 -36.69 70.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 3.19 110.25 -179.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.424 ' HB2' HG13 ' A' ' 34' ' ' ILE . 11.1 mmmm -59.18 -29.76 67.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.701 -0.681 . . . . 2.45 111.269 -178.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.89 68.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.828 0.347 . . . . 0.29 110.676 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.776 HD12 ' HB3' ' A' ' 6' ' ' ASP . 37.1 mt -72.21 -34.19 48.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 120.911 0.386 . . . . 1.13 110.578 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 16.4 mm-40 -55.29 -39.62 70.08 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.219 -0.66 . . . . 2.1 109.219 172.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.814 HD22 ' HB3' ' A' ' 73' ' ' LEU . 66.8 mt -67.4 -35.51 79.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.346 -0.843 . . . . 0.29 111.101 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.627 HD21 HD13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -60.4 -37.23 80.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.906 0.384 . . . . 1.36 111.07 178.307 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.452 ' HE2' ' HA ' ' A' ' 41' ' ' GLU . 39.5 mtm -72.53 -36.49 68.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.265 0.555 . . . . 2.2 109.632 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -71.07 -28.36 64.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.538 -0.755 . . . . 1.83 111.317 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.86 HG23 HD11 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -61.0 -35.95 78.19 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 110.235 -0.283 . . . . 1.03 110.235 178.064 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -65.52 -35.07 79.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.048 0.452 . . . . 0.88 110.714 175.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.57 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 30.2 tt0 -68.31 -39.9 81.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.174 0.511 . . . . 2.51 109.657 178.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.4 t -69.11 -33.54 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.76 110.035 173.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.728 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 2.6 mm-40 -59.96 -44.06 94.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 1.96 111.233 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.57 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 1.9 pt20 -72.82 -19.73 61.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 2.25 111.245 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -100.09 -25.28 14.35 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.04 0.448 . . . . 2.34 111.766 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.21 41.67 25.81 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.963 -0.562 . . . . 1.33 113.228 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.87 128.99 9.41 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.55 -0.833 . . . . 0.89 113.922 -175.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 1.114 HD23 ' HB2' ' A' ' 72' ' ' ASN . 2.2 tm? -177.43 125.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.947 0.403 . . . . 1.38 110.43 170.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.53 ' N ' HD22 ' A' ' 55' ' ' LEU . 94.1 m-85 -124.26 108.69 12.51 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.498 -0.927 . . . . 2.87 108.498 165.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.847 HG23 HD11 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -82.84 -176.57 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.193 -0.458 . . . . 0.68 111.438 -178.277 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.796 ' HE3' " O3'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -52.81 -36.32 58.25 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.999 0.741 . . . . 0.91 112.999 -173.416 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.595 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 0.1 OUTLIER -88.71 -35.52 16.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.606 0.595 . . . . 2.28 112.606 -179.069 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.87 -19.86 10.89 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 121.64 -0.314 . . . . 1.21 112.492 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.595 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 57.8 m -71.13 -58.41 3.58 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.971 0.415 . . . . 2.18 110.145 177.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.431 ' HD2' H5'' ' P' ' 602' ' ' ' C' . 99.8 mtt180 -67.96 138.1 55.67 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.655 -1.239 . . . . 2.89 107.655 167.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -142.63 126.01 16.65 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.421 -0.585 . . . . 3.59 109.421 -172.664 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.79 ' HD2' HG22 ' A' ' 69' ' ' VAL . 0.0 OUTLIER 62.51 56.07 2.12 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.476 -0.784 . . . . 1.98 112.194 -175.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.891 HG23 ' HA3' ' A' ' 68' ' ' GLY . 2.2 t -78.82 139.21 57.74 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 108.114 -1.069 . . . . 0.44 108.114 167.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.529 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.32 -59.76 1.1 Allowed 'Trans proline' 0 N--CA 1.48 0.685 0 C-N-CA 123.459 2.773 . . . . 0.44 112.978 -173.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.7 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -66.35 -38.86 94.0 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.407 -0.902 . . . . 0.25 111.245 177.3 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.891 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.68 -34.97 65.41 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.333 -0.433 . . . . 0.3 112.909 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.79 HG22 ' HD2' ' A' ' 64' ' ' ARG . 98.8 t -59.04 -42.78 87.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.106 0.479 . . . . 0.74 110.133 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.555 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 10.5 t80 -65.59 -37.01 85.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.825 -0.625 . . . . 0.26 109.975 174.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.7 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.39 -34.58 70.88 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.761 -0.829 . . . . 0.32 108.761 177.744 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 1.114 ' HB2' HD23 ' A' ' 55' ' ' LEU . 65.4 t30 -60.04 -30.61 69.3 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.656 -0.702 . . . . 1.08 110.186 177.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.86 HD11 HG23 ' A' ' 46' ' ' THR . 84.9 mt -58.62 -34.26 70.95 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.619 -0.719 . . . . 0.46 112.111 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.813 ' HB3' HG23 ' A' ' 85' ' ' ILE . 7.3 mp -65.73 -20.34 66.24 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.109 0.48 . . . . 1.08 110.795 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.702 ' HD3' ' C5 ' ' P' ' 600' ' ' ' A' . 8.9 mtmm -92.79 -34.35 13.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.281 0.562 . . . . 1.93 110.254 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -87.46 -13.11 44.1 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.154 -0.93 . . . . 2.12 110.877 -173.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.512 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 14.7 t -62.76 130.26 93.64 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.737 0.78 . . . . 0.94 110.751 -177.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 2.8 Cg_exo -74.86 -39.95 1.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.439 2.76 . . . . 1.0 113.725 -171.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.2 m -112.94 16.15 19.5 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.105 1.15 . . . . 1.49 114.105 -167.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.419 HD13 HG21 ' A' ' 34' ' ' ILE . 55.8 mt -112.6 137.69 44.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 118.683 0.674 . . . . 1.21 111.437 -177.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.4 m -74.04 141.44 45.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.523 -0.762 . . . . 1.79 111.042 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.15 -27.56 69.04 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.182 -0.917 . . . . 2.89 112.869 -174.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.84 -46.72 84.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 2.06 110.137 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.564 ' O ' HG13 ' A' ' 88' ' ' ILE . 77.9 mm-40 -60.68 -38.86 86.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 2.31 109.869 177.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.813 HG23 ' HB3' ' A' ' 74' ' ' LEU . 33.4 mm -60.03 -50.65 79.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.377 -0.829 . . . . 1.41 110.608 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.546 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 18.8 ttpt -60.06 -43.46 95.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.608 -0.724 . . . . 2.45 110.284 176.022 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -63.72 -34.31 77.58 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.411 -0.813 . . . . 1.7 111.715 -174.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.67 HD13 ' HA ' ' A' ' 30' ' ' VAL . 72.9 mt -70.29 -72.34 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.174 0.435 . . . . 0.42 112.174 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.856 ' HB3' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -106.48 -16.38 14.55 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.361 0.874 . . . . 0.75 113.361 -168.589 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.662 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 86.9 t80 -77.47 -24.75 50.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.355 0.598 . . . . 1.13 110.212 -173.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt -82.65 -23.12 8.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.561 -0.745 . . . . 0.86 109.721 174.051 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 53.22 -93.65 0.03 OUTLIER 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.77 -1.105 . . . . 2.67 111.175 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -145.98 22.37 1.4 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.004 0.43 . . . . 4.7 110.27 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -61.09 139.38 58.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.566 -0.743 . . . . 3.67 110.777 -177.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LYS . . . . . 0.423 ' HE2' ' CE2' ' A' ' 97' ' ' TYR . 26.3 pttm -127.39 -175.8 3.55 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.366 -0.605 . . . . 7.97 109.366 177.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.58 120.18 26.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.426 0.632 . . . . 7.59 111.632 -174.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.423 ' CE2' ' HE2' ' A' ' 95' ' ' LYS . 34.6 m-85 -84.88 58.69 5.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.807 -0.633 . . . . 8.84 109.723 172.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 60.12 26.81 16.22 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.801 -0.636 . . . . 10.06 110.978 -177.282 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 66.31 -81.64 0.03 OUTLIER 'General case' 0 C--O 1.234 0.241 0 CA-C-N 114.967 -1.015 . . . . 12.32 112.188 176.012 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -115.08 -55.63 2.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.209 0.528 . . . . 14.02 110.701 -177.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . 35.4 ttpt -87.07 78.77 8.86 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.92 -0.582 . . . . 15.92 110.902 -175.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.64 93.9 6.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.807 -0.633 . . . . 17.13 109.992 175.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -75.09 91.17 2.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.167 0.508 . . . . 18.06 111.119 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.927 -1.035 . . . . 19.51 109.717 177.537 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' P' P ' 600' ' ' ' A' . . . . . 0.842 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.515 -0.933 0 C4'-C3'-C2' 99.678 -3.022 OUTLIER-DELTA 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 601' ' ' ' U' . . . . . 0.796 " O3'" ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.51 -1.36 1 C4'-C3'-C2' 96.369 -6.331 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 001 nuclear build full ' P' P ' 602' ' ' ' C' . . . . . 0.658 ' OP1' ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 P-O3'-C3' 120.687 0.823 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.882 0 C4'-C3'-C2' 103.809 1.109 . 0.049 1t . 7.45 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 112.023 -0.431 . . . . 9.19 112.023 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 56.58 43.58 25.42 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 122.942 0.497 . . . . 7.69 111.432 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 15.9 tpt -132.15 -64.07 0.79 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.461 -0.336 . . . . 7.18 110.829 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -162.42 52.89 0.21 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.988 0.423 . . . . 4.5 110.425 -176.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -71.55 -46.51 59.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.118 0.485 . . . . 4.1 110.044 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -120.86 59.41 0.93 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.736 -0.665 . . . . 1.79 109.693 -178.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.437 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.2 m -58.33 124.34 19.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.66 -0.496 . . . . 1.33 109.66 176.116 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.474 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.9 mt-30 -57.21 -32.28 66.33 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.883 -0.599 . . . . 1.88 112.155 -169.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.92 -42.1 73.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.065 0.46 . . . . 2.17 110.291 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -71.03 -38.87 72.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.815 -0.63 . . . . 2.55 110.277 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.655 ' O ' HG12 ' A' ' 15' ' ' ILE . 69.3 t -58.12 -51.53 69.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.39 110.981 178.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.95 -37.52 63.99 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.088 0.47 . . . . 0.35 111.155 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -68.69 -41.23 79.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.643 -0.708 . . . . 0.86 110.191 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 41.1 mm-40 -64.77 -47.41 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.572 -0.74 . . . . 2.05 111.907 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.756 HG23 HD21 ' A' ' 43' ' ' LEU . 3.4 mm -60.38 -49.87 82.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.887 0.375 . . . . 0.33 110.326 -175.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.6 ' HB3' HG21 ' A' ' 27' ' ' ILE . 23.1 p -61.16 -32.66 72.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.95 -0.568 . . . . 0.32 111.314 -176.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -70.54 -44.98 66.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.162 -0.472 . . . . 0.59 110.649 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 77.8 mtt180 -75.25 -31.36 60.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 2.83 111.693 -173.199 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.633 HD11 ' HB2' ' A' ' 70' ' ' PHE . 3.9 mm? -82.54 -15.56 51.86 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.623 -0.431 . . . . 0.99 111.173 174.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 55.18 29.91 13.54 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 108.395 -0.965 . . . . 1.6 108.395 -170.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.492 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 24.7 tt0 -71.73 132.96 84.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 113.904 -1.498 . . . . 1.31 112.271 -168.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.58 ' HD2' ' O4 ' ' P' ' 601' ' ' ' U' . 38.8 Cg_endo -63.47 -49.01 4.94 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 124.737 3.625 . . . . 0.41 113.625 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.604 ' HD2' ' HB3' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -89.99 69.81 7.41 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.006 0.908 . . . . 1.41 110.708 -175.314 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.505 ' O ' HG22 ' A' ' 27' ' ' ILE . 77.7 mttt -66.88 -23.82 66.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.175 . . . . 1.75 112.513 -170.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.37 -37.28 86.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.364 0.602 . . . . 2.14 110.021 175.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.604 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 1.4 tm? -72.93 -40.98 64.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.348 -0.842 . . . . 1.33 110.479 -178.063 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.6 HG21 ' HB3' ' A' ' 16' ' ' SER . 3.8 tp -63.09 -31.15 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 121.079 0.466 . . . . 0.44 109.919 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.656 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.48 -34.09 65.17 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.913 -0.585 . . . . 0.21 110.562 174.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -62.3 -41.38 98.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.211 -0.45 . . . . 1.48 110.923 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 34' ' ' ILE . 19.9 t -54.02 -44.59 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 N-CA-C 109.001 -0.74 . . . . 1.1 109.001 177.476 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.656 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 91.8 t -53.2 -49.04 53.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 114.34 -1.3 . . . . 0.22 111.038 175.389 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 32' ' ' ARG . 49.4 mtt180 -60.55 -47.48 86.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.586 -0.734 . . . . 3.75 110.862 -178.583 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 41.7 mm -73.94 -52.24 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.701 -0.681 . . . . 0.8 112.329 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.609 HG12 ' O ' ' A' ' 30' ' ' VAL . 21.4 pt -84.94 -28.86 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.628 -0.429 . . . . 0.4 111.944 -172.169 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.21 155.98 9.94 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.4 -0.905 . . . . 0.26 112.263 -179.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.474 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 4.7 p30 -59.51 -49.42 77.84 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.778 0.288 . . . . 0.91 111.778 -175.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -71.62 -33.67 69.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.811 0.339 . . . . 3.19 111.05 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.473 ' HB2' HG13 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -64.26 -31.68 72.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.038 -0.528 . . . . 2.45 110.832 -178.222 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.487 ' O ' ' HG ' ' A' ' 43' ' ' LEU . . . -64.15 -44.73 91.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.28 -0.418 . . . . 0.29 110.454 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.05 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.124 -0.489 . . . . 1.13 110.317 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 51.4 mt-10 -58.41 -42.95 88.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.127 -0.488 . . . . 2.1 110.822 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.839 ' HB3' HD13 ' A' ' 73' ' ' LEU . 53.1 mt -63.27 -37.87 88.95 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.512 -0.313 . . . . 0.29 110.847 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.756 HD21 HG23 ' A' ' 15' ' ' ILE . 85.6 mt -60.99 -30.78 70.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.073 0.463 . . . . 1.36 111.123 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.2 tmm? -73.99 -39.17 63.85 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.352 -0.611 . . . . 2.2 109.352 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 31.0 mt-10 -70.45 -25.49 63.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.658 -0.701 . . . . 1.83 112.464 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.655 HG22 HD11 ' A' ' 73' ' ' LEU . 71.2 p -52.04 -41.5 62.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.921 0.391 . . . . 1.03 110.717 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.56 -35.07 75.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.684 -0.689 . . . . 0.88 111.418 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -68.85 -33.93 74.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.984 0.421 . . . . 2.51 110.498 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 81.5 t -76.96 -35.81 24.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.967 0.413 . . . . 0.76 110.323 174.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.567 ' HA ' HH21 ' A' ' 64' ' ' ARG . 6.7 mm-40 -61.05 -43.56 98.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.042 -0.526 . . . . 1.96 111.361 177.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -69.81 -26.27 64.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.813 0.339 . . . . 2.25 110.782 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -83.17 -25.07 32.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 2.34 111.04 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.501 ' HA2' ' NH1' ' A' ' 64' ' ' ARG . . . 72.95 44.4 37.09 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.521 -0.763 . . . . 1.33 111.804 -178.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.43 126.01 7.09 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.248 -0.977 . . . . 0.89 114.865 -170.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.75 HD13 ' HB2' ' A' ' 72' ' ' ASN . 38.6 tp -176.87 127.72 0.17 Allowed 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.23 0.538 . . . . 1.38 111.72 163.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -119.27 112.69 19.79 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 107.971 -1.122 . . . . 2.87 107.971 163.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.871 HG22 " H4'" ' P' ' 600' ' ' ' A' . 1.1 pt -86.96 -165.36 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.805 -0.634 . . . . 0.68 111.516 -175.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.751 ' HG3' " C3'" ' P' ' 601' ' ' ' U' . 3.9 mtt -42.12 -46.33 4.28 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.876 0.735 . . . . 0.91 111.806 -173.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -120.82 -33.27 3.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.101 -0.499 . . . . 2.28 111.193 -174.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.456 ' O ' ' HB3' ' A' ' 63' ' ' ARG . . . 106.16 -12.07 44.41 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.285 -0.96 . . . . 1.21 115.257 172.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 65.8 p -65.28 -55.88 15.85 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 118.46 1.13 . . . . 2.18 111.17 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.576 ' C ' HD11 ' A' ' 57' ' ' ILE . 60.4 mtp180 -81.71 26.9 0.47 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.528 -0.76 . . . . 2.89 110.368 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.589 ' HA ' HG12 ' A' ' 57' ' ' ILE . 25.8 ptt180 -46.53 133.39 10.15 Favored 'General case' 0 C--O 1.233 0.21 0 O-C-N 123.916 0.76 . . . . 3.59 112.434 -169.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.892 ' HD2' HG22 ' A' ' 69' ' ' VAL . 4.8 tpt180 73.14 80.67 0.13 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.002 -0.999 . . . . 1.98 111.817 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.873 HG23 ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER -105.36 147.72 35.08 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.885 -1.052 . . . . 0.44 108.279 172.127 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.481 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.9 Cg_endo -45.76 -59.69 1.1 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 123.536 2.824 . . . . 0.44 112.998 -176.033 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.689 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -63.31 -40.74 99.31 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.085 -1.055 . . . . 0.25 110.85 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.873 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.46 -29.56 57.43 Favored Glycine 0 CA--C 1.52 0.379 0 CA-C-N 115.139 -0.53 . . . . 0.3 113.289 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.892 HG22 ' HD2' ' A' ' 64' ' ' ARG . 41.5 t -67.75 -33.59 62.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.118 0.485 . . . . 0.74 109.997 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.633 ' HB2' HD11 ' A' ' 19' ' ' LEU . 12.1 t80 -65.23 -35.74 81.98 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.305 -0.628 . . . . 0.26 109.305 171.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.689 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.22 -36.26 72.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.462 -0.94 . . . . 0.32 108.462 178.532 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.75 ' HB2' HD13 ' A' ' 55' ' ' LEU . 44.0 t-20 -56.58 -35.21 67.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.651 -0.704 . . . . 1.08 109.9 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.839 HD13 ' HB3' ' A' ' 42' ' ' LEU . 95.6 mt -58.13 -37.01 73.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.153 -0.931 . . . . 0.46 112.178 -176.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.876 ' HB3' HG23 ' A' ' 85' ' ' ILE . 6.4 mp -65.83 -28.87 69.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.162 0.506 . . . . 1.08 110.479 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.551 ' HD2' ' C2 ' ' P' ' 600' ' ' ' A' . 0.0 OUTLIER -80.92 -42.5 21.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.121 0.486 . . . . 1.93 110.648 176.715 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -100.28 26.12 6.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.728 -0.669 . . . . 2.12 111.363 -173.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.501 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 5.4 t -80.95 124.73 81.19 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 121.447 0.642 . . . . 0.94 110.517 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.4 Cg_exo -75.78 -9.97 19.83 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.29 2.66 . . . . 1.0 113.01 -176.62 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.5 m -111.51 -20.71 12.1 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.208 0.818 . . . . 1.49 113.208 -170.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.423 ' HB ' HG21 ' A' ' 77' ' ' THR . 17.7 mt -111.4 139.87 33.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.774 0.321 . . . . 1.21 111.313 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.8 t -76.17 142.0 41.69 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.31 0.576 . . . . 1.79 110.044 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.402 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 1.8 mp0 -57.23 -37.59 72.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.691 -1.141 . . . . 2.89 113.116 -168.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.54 -37.28 85.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 2.06 110.764 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -68.37 -23.64 64.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.587 0.708 . . . . 2.31 110.073 -177.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.876 HG23 ' HB3' ' A' ' 74' ' ' LEU . 46.5 mm -70.73 -36.96 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.839 -1.073 . . . . 1.41 111.169 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.555 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 37.4 ttmt -56.83 -36.15 69.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.485 -0.78 . . . . 2.45 111.896 -177.249 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.52 -33.29 69.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 1.7 111.629 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.7 mt -70.95 -72.21 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 113.167 0.803 . . . . 0.42 113.167 -170.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.728 ' H ' ' HD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -104.3 -19.19 14.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.695 0.628 . . . . 0.75 112.695 -166.854 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.555 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 60.5 t80 -74.83 -23.86 58.52 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.311 0.577 . . . . 1.13 110.945 -173.724 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 47.1 mt -88.99 -8.12 10.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.605 -0.725 . . . . 0.86 111.022 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 55.47 -95.31 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.399 0.618 . . . . 2.67 111.677 -176.665 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -139.46 16.54 2.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.484 -0.78 . . . . 4.7 109.817 -178.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -73.9 75.0 1.65 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.499 0.666 . . . . 3.67 111.266 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 43.6 pttt -128.04 116.19 19.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.318 -0.856 . . . . 7.97 108.81 173.119 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -98.73 -48.58 4.9 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.079 -0.51 . . . . 7.59 111.312 -172.56 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -98.11 62.84 1.56 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.082 0.468 . . . . 8.84 112.241 -170.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -108.47 125.35 51.69 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.98 -1.119 . . . . 10.06 107.98 164.464 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -78.06 80.17 4.5 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.939 0.4 . . . . 12.32 111.683 -173.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.12 55.09 2.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 122.026 0.917 . . . . 14.02 108.742 172.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 56.2 pttt -158.71 144.41 16.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.725 -1.125 . . . . 15.92 108.832 -177.39 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 59.65 29.58 19.15 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.289 0.566 . . . . 17.13 110.284 -173.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -157.36 -165.18 1.74 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.302 -0.863 . . . . 18.06 109.811 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.991 -0.528 . . . . 19.51 110.934 -179.982 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' P' P ' 600' ' ' ' A' . . . . . 0.871 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.514 -0.99 0 C3'-C2'-C1' 98.232 -3.631 OUTLIER-DELTA 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 601' ' ' ' U' . . . . . 0.751 " C3'" ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.51 -1.385 1 C4'-C3'-C2' 96.042 -6.658 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 002 nuclear build full ' P' P ' 602' ' ' ' C' . . . . . 0.565 ' OP1' ' HB ' ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.424 -0.986 0 C4'-C3'-C2' 104.67 1.97 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.933 0 C4'-C3'-C2' 105.726 3.026 . 0.0 OUTLIER gamma 7.45 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 N-CA-C 111.555 -0.618 . . . . 9.19 111.555 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.94 -49.58 5.97 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.487 0.184 . . . . 7.69 111.198 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -159.59 164.22 34.39 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.105 0.479 . . . . 7.18 110.85 -175.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -130.15 103.51 6.77 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.638 -0.71 . . . . 4.5 109.877 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -84.54 85.5 7.41 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.458 0.647 . . . . 4.1 109.568 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.53 ' HB2' ' CG2' ' A' ' 11' ' ' VAL . 12.0 p-10 -75.99 105.59 7.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.008 -0.996 . . . . 1.79 111.67 -172.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.465 ' O ' HG23 ' A' ' 11' ' ' VAL . 17.5 m -79.86 127.87 32.75 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.443 -0.799 . . . . 1.33 109.363 175.279 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.714 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 14.2 pt20 -51.91 -43.65 63.49 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.731 1.011 . . . . 1.88 113.731 -167.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -71.36 -34.95 70.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.115 0.483 . . . . 2.17 110.268 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -65.67 -42.19 91.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 2.55 109.666 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.568 ' O ' HG12 ' A' ' 15' ' ' ILE . 60.2 t -62.15 -42.85 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.602 -0.726 . . . . 0.39 110.431 176.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.73 -41.7 77.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 0.35 111.36 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.27 -31.11 71.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.318 -0.401 . . . . 0.86 110.418 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.64 -50.54 64.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.463 -0.335 . . . . 2.05 110.779 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.861 HG23 HD21 ' A' ' 43' ' ' LEU . 2.0 mm -60.57 -49.48 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.768 0.318 . . . . 0.33 110.555 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.532 ' HB2' ' HD2' ' A' ' 24' ' ' LYS . 18.9 p -57.96 -43.04 86.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.864 -0.607 . . . . 0.32 111.454 -176.052 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.72 -41.52 98.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.666 -0.697 . . . . 0.59 111.141 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -77.42 -36.91 52.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 2.83 111.905 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.86 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.5 mm? -83.04 -5.61 59.17 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.973 0.36 . . . . 0.99 111.973 -178.167 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 55.82 39.97 30.68 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.762 -0.829 . . . . 1.6 108.762 -172.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.8 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.12 120.34 63.5 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.31 -1.313 . . . . 1.31 111.753 -171.065 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.429 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 71.6 Cg_endo -70.08 -34.96 12.55 Favored 'Trans proline' 0 N--CA 1.474 0.351 0 C-N-CA 123.976 3.117 . . . . 0.41 113.478 177.088 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.675 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 35.5 pttt -120.38 66.24 0.83 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.319 0.58 . . . . 1.41 109.499 -173.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.532 ' HD2' ' HB2' ' A' ' 16' ' ' SER . 40.1 mtmt -61.06 -12.41 11.78 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.035 1.124 . . . . 1.75 114.035 -163.265 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -69.23 -28.66 66.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.339 -0.544 . . . . 2.14 109.581 173.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.855 HD21 ' HA ' ' A' ' 89' ' ' PHE . 1.8 tm? -71.84 -52.05 19.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.46 -0.791 . . . . 1.33 109.926 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.8 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 10.1 tp -62.22 -34.58 64.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 0.44 110.525 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.71 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -70.88 -32.24 69.16 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.548 0.69 . . . . 0.21 110.477 174.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.43 ' O ' HG12 ' A' ' 33' ' ' ILE . 36.4 ttm180 -66.91 -41.6 86.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.548 -0.751 . . . . 1.48 111.587 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.729 HG21 ' HE1' ' A' ' 70' ' ' PHE . 16.3 t -53.4 -44.72 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 108.66 -0.867 . . . . 1.1 108.66 176.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.71 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.1 t -52.51 -53.42 20.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 113.63 -1.623 . . . . 0.22 111.201 175.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -66.24 -35.51 80.6 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.56 -0.745 . . . . 3.75 112.06 -174.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.636 HG13 HG12 ' A' ' 88' ' ' ILE . 50.5 mm -75.03 -51.82 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.294 0.479 . . . . 0.8 112.294 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.786 HG21 HD13 ' A' ' 80' ' ' ILE . 33.7 pt -90.18 -25.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.89 0.376 . . . . 0.4 111.854 -175.126 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.1 139.56 6.24 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.722 -0.751 . . . . 0.26 111.356 -175.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.714 ' HB3' ' HA ' ' A' ' 8' ' ' GLN . 0.9 OUTLIER -55.55 -37.95 68.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.834 0.349 . . . . 0.91 111.86 -179.195 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.47 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 34.0 ttmt -71.58 -33.87 69.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.145 0.498 . . . . 3.19 110.262 -178.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -69.86 -31.12 68.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.934 -0.576 . . . . 2.45 110.714 176.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.79 -38.66 91.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.13 0.49 . . . . 0.29 110.222 175.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.26 -41.65 93.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 115.912 -0.585 . . . . 1.13 110.441 176.341 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -55.73 -47.0 77.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.779 -0.646 . . . . 2.1 110.448 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.753 ' HB3' HD13 ' A' ' 73' ' ' LEU . 48.5 mt -60.58 -38.62 85.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.619 -0.719 . . . . 0.29 111.26 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.861 HD21 HG23 ' A' ' 15' ' ' ILE . 14.4 mt -60.05 -32.48 70.96 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.877 0.37 . . . . 1.36 111.498 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.8 mtp -74.59 -37.01 63.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.111 0.481 . . . . 2.2 109.881 175.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.418 ' O ' HG23 ' A' ' 49' ' ' VAL . 52.3 mt-10 -70.55 -27.45 64.15 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.444 -0.798 . . . . 1.83 111.623 179.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.534 HG23 HD11 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -62.87 -39.12 93.46 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.767 0.317 . . . . 1.03 110.833 -177.878 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.59 -44.15 89.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.53 . . . . 0.88 111.785 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.932 ' HA ' ' HG2' ' A' ' 51' ' ' GLN . 6.6 pt-20 -75.69 -30.27 59.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.671 -0.412 . . . . 2.51 111.422 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 45' ' ' GLU . 84.5 t -65.23 -35.62 75.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.496 0.665 . . . . 0.76 109.421 173.48 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.428 ' CG ' HG11 ' A' ' 69' ' ' VAL . 40.6 mt-10 -69.29 -47.02 65.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.553 -0.748 . . . . 1.96 111.121 175.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.932 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 17.0 pt20 -65.12 -27.04 68.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 2.25 110.728 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 95.8 m-20 -94.27 -4.19 49.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.047 -0.524 . . . . 2.34 111.454 -177.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.23 50.08 41.76 Favored Glycine 0 C--N 1.331 0.28 0 CA-C-N 115.919 -0.582 . . . . 1.33 113.386 176.302 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -108.93 111.96 3.37 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.231 -0.985 . . . . 0.89 113.975 -177.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.763 HD21 HG23 ' A' ' 57' ' ' ILE . 34.6 tp -177.34 126.95 0.15 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.576 0.584 . . . . 1.38 112.576 167.178 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -125.65 93.54 3.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.592 -0.731 . . . . 2.87 109.081 164.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.91 HG22 " H4'" ' P' ' 600' ' ' ' A' . 3.8 pt -72.15 -170.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 112.451 0.537 . . . . 0.68 112.451 -176.322 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.679 ' HG3' " C3'" ' P' ' 601' ' ' ' U' . 2.7 mtt -42.01 -47.63 4.46 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.88 0.738 . . . . 0.91 111.468 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.52 ' ND2' H5'' ' P' ' 602' ' ' ' C' . 6.1 p30 -103.89 -35.81 8.02 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.797 -0.638 . . . . 2.28 111.746 -172.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 97.13 -19.52 54.47 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.069 -0.586 . . . . 1.21 113.701 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.465 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 66.1 m -72.61 -45.5 58.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.183 0.492 . . . . 2.18 111.251 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.746 ' HB3' HD11 ' A' ' 57' ' ' ILE . 7.4 ttm180 -80.47 49.37 1.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.91 0.862 . . . . 2.89 109.091 176.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.4 123.17 12.15 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.651 -1.159 . . . . 3.59 111.543 -173.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.742 ' HD2' HG22 ' A' ' 69' ' ' VAL . 1.2 mmm180 72.27 56.81 0.15 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 113.452 0.908 . . . . 1.98 113.452 173.121 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.714 HG23 ' HA3' ' A' ' 68' ' ' GLY . 3.9 t -77.74 140.65 63.51 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.657 -0.701 . . . . 0.44 109.159 169.228 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -48.18 -59.45 1.24 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 C-N-CA 124.047 3.165 . . . . 0.44 113.43 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.86 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -62.26 -39.86 98.26 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.868 -0.893 . . . . 0.25 110.868 177.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.714 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -58.94 -31.67 68.85 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.109 -0.546 . . . . 0.3 113.247 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.742 HG22 ' HD2' ' A' ' 64' ' ' ARG . 43.2 t -62.76 -36.39 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.181 0.515 . . . . 0.74 110.239 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.729 ' HE1' HG21 ' A' ' 30' ' ' VAL . 13.4 t80 -65.48 -36.37 83.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.955 -0.566 . . . . 0.26 109.634 173.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.631 HD12 " O5'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -59.4 -34.64 72.7 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.605 -0.887 . . . . 0.32 108.605 178.387 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.676 ' HB2' HD13 ' A' ' 55' ' ' LEU . 62.1 t30 -61.27 -30.41 70.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.266 -0.879 . . . . 1.08 110.489 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.753 HD13 ' HB3' ' A' ' 42' ' ' LEU . 71.1 mt -57.99 -36.09 72.14 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.296 -0.865 . . . . 0.46 111.885 -177.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.943 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.2 mp -60.83 -21.9 63.64 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.105 0.478 . . . . 1.08 110.859 -178.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.501 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -93.05 -38.45 11.62 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.989 -0.445 . . . . 1.93 111.576 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.63 ' OD1' ' HA ' ' A' ' 73' ' ' LEU . 2.9 p-10 -93.37 -8.14 42.73 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.914 -0.315 . . . . 2.12 111.648 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.55 HG21 ' HB ' ' A' ' 80' ' ' ILE . 7.9 t -56.22 127.65 70.98 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.436 0.636 . . . . 0.94 111.333 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.3 Cg_exo -76.07 -14.82 18.76 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.551 2.834 . . . . 1.0 113.055 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.6 m -112.31 -17.27 12.78 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.451 0.908 . . . . 1.49 113.451 -169.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.786 HD13 HG21 ' A' ' 34' ' ' ILE . 36.5 mt -103.84 139.98 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.03 0.443 . . . . 1.21 112.096 -169.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.425 ' O ' HG12 ' A' ' 85' ' ' ILE . 46.9 m -84.33 156.57 21.84 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.805 -0.634 . . . . 1.79 111.678 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.458 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 34.3 tt0 -65.92 -41.31 91.55 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.248 1.203 . . . . 2.89 114.248 -164.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.86 -47.03 85.13 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.55 -0.46 . . . . 2.06 111.63 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.571 ' O ' HG13 ' A' ' 88' ' ' ILE . 46.9 mt-30 -56.83 -33.56 66.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 2.31 110.528 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.943 HG23 ' HB3' ' A' ' 74' ' ' LEU . 36.3 mm -60.12 -50.74 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.796 -0.638 . . . . 1.41 110.652 177.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.8 ttpt -59.25 -39.1 81.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 2.45 110.753 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -65.84 -33.07 74.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.437 -0.347 . . . . 1.7 111.652 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.709 HG21 HG22 ' A' ' 30' ' ' VAL . 75.2 mt -70.44 -71.44 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.457 0.54 . . . . 0.42 112.457 -174.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.855 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -104.8 -10.78 17.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.32 0.859 . . . . 0.75 113.32 -165.836 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.536 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.9 t80 -89.46 -22.51 22.46 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.167 0.508 . . . . 1.13 110.947 -173.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.5 mt -88.78 -29.04 5.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.092 -0.504 . . . . 0.86 110.852 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 60.58 -83.61 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.501 -0.772 . . . . 2.67 111.124 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 23.1 p-10 -161.28 20.1 0.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.968 0.413 . . . . 4.7 110.331 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -84.65 59.59 5.6 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.144 0.497 . . . . 3.67 111.358 -175.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -146.35 127.21 14.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.813 -0.63 . . . . 7.97 110.463 177.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 72.72 -67.35 0.27 Allowed 'General case' 0 N--CA 1.465 0.31 0 O-C-N 123.918 0.761 . . . . 7.59 112.785 171.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -96.76 81.7 3.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.439 0.638 . . . . 8.84 111.865 -170.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.4 ' H ' ' HG3' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -102.21 172.14 7.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.207 -0.906 . . . . 10.06 109.626 174.469 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -119.23 68.76 0.81 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.874 0.368 . . . . 12.32 110.947 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.483 ' NZ ' ' HB2' ' A' ' 100' ' ' LYS . 4.7 ttmp? -108.85 90.12 3.2 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.906 0.384 . . . . 14.02 110.296 176.17 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -82.23 -19.47 39.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.019 0.438 . . . . 15.92 110.733 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -83.24 6.29 20.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.072 -0.513 . . . . 17.13 111.048 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -74.2 87.56 1.95 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.095 -0.502 . . . . 18.06 110.703 178.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 104' ' ' ARG . 15.3 tpt180 . . . . . 0 C--O 1.246 0.921 0 CA-C-O 118.259 -0.877 . . . . 19.51 109.614 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' P' P ' 600' ' ' ' A' . . . . . 0.91 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.515 -0.909 0 C3'-C2'-C1' 99.057 -2.714 OUTLIER-DELTA 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 601' ' ' ' U' . . . . . 0.679 " C3'" ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.51 -1.359 1 C4'-C3'-C2' 96.136 -6.564 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 003 nuclear build full ' P' P ' 602' ' ' ' C' . . . . . 0.52 H5'' ' ND2' ' A' ' 59' ' ' ASN . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 P-O3'-C3' 122.356 2.214 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 C3'-C2'-C1' 99.994 -1.673 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.785 -0.526 . . . . 9.19 111.785 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.27 77.13 1.93 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.836 0.35 . . . . 7.69 110.778 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 48.8 ttm -107.58 -52.63 2.74 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.841 0.353 . . . . 7.18 110.824 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.33 32.81 4.81 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.244 -0.435 . . . . 4.5 111.074 -177.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -95.8 165.16 12.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.381 -0.372 . . . . 4.1 110.21 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -109.31 68.59 0.68 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.188 0.518 . . . . 1.79 109.944 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -56.03 131.84 48.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.463 -0.79 . . . . 1.33 109.427 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.574 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 96.7 mt-30 -58.44 -33.31 69.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.031 -0.531 . . . . 1.88 112.249 -173.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.15 -40.23 86.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.133 0.492 . . . . 2.17 110.42 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 62.5 tttm -70.24 -42.37 72.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.759 -0.655 . . . . 2.55 110.262 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.664 ' O ' HG12 ' A' ' 15' ' ' ILE . 91.1 t -59.26 -42.61 87.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.39 110.598 177.381 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.68 -41.42 73.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.038 0.447 . . . . 0.35 110.57 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -67.35 -42.12 84.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 0.86 110.426 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.568 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 71.6 mm-40 -56.86 -51.03 70.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.108 -0.496 . . . . 2.05 110.74 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.664 HG12 ' O ' ' A' ' 11' ' ' VAL . 4.6 mm -63.47 -51.8 66.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 120.709 -0.396 . . . . 0.33 110.318 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.679 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 31.4 p -64.03 -41.59 97.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.445 -0.343 . . . . 0.32 111.759 -172.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -62.54 -44.62 95.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.066 0.46 . . . . 0.59 110.646 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.2 mtt180 -78.73 -31.16 46.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.202 -0.454 . . . . 2.83 111.833 -175.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 1.07 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.3 mm? -77.56 -15.73 59.08 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 111.926 0.343 . . . . 0.99 111.926 177.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 57.15 41.22 27.48 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 107.65 -1.241 . . . . 1.6 107.65 -166.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.679 ' HB3' ' HA ' ' A' ' 16' ' ' SER . 7.2 tp10 -81.18 115.7 57.95 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 113.243 -1.799 . . . . 1.31 110.968 -170.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.444 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 42.2 Cg_endo -61.98 -47.88 9.66 Favored 'Trans proline' 0 N--CA 1.477 0.535 0 C-N-CA 124.416 3.411 . . . . 0.41 113.521 177.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.653 ' HE2' ' C5 ' ' P' ' 601' ' ' ' U' . 45.1 pttt -92.59 72.52 5.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.058 0.932 . . . . 1.41 109.649 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.665 ' HA ' HG22 ' A' ' 27' ' ' ILE . 65.5 mttt -65.23 -17.66 64.67 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.428 -1.26 . . . . 1.75 111.441 -173.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.34 -39.06 59.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.418 -0.355 . . . . 2.14 110.524 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.588 ' HG ' ' OE2' ' A' ' 92' ' ' GLU . 1.8 tm? -73.43 -43.61 60.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.003 0.43 . . . . 1.33 109.966 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.672 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 10.6 tp -64.08 -26.92 41.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.969 -0.56 . . . . 0.44 109.756 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.687 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.22 -33.31 65.27 Favored 'General case' 0 CA--C 1.523 -0.073 0 CA-C-N 116.267 -0.424 . . . . 0.21 110.934 172.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.637 ' HG2' HG23 ' A' ' 88' ' ' ILE . 6.3 ttm180 -59.35 -45.74 90.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.718 0.266 . . . . 1.48 111.718 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.66 ' O ' HG12 ' A' ' 34' ' ' ILE . 9.5 p -57.55 -36.71 54.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.594 -0.521 . . . . 1.1 109.594 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.687 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 76.8 t -54.87 -50.51 61.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.112 -0.949 . . . . 0.22 110.779 173.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -63.49 -43.19 97.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.398 -0.819 . . . . 3.75 111.41 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.843 HD12 HG12 ' A' ' 88' ' ' ILE . 17.2 mt -74.96 -51.89 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.02 0.748 . . . . 0.8 113.02 -172.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 30' ' ' VAL . 34.1 pt -88.34 -28.2 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 120.274 -0.57 . . . . 0.4 111.661 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 153.86 8.66 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.363 -0.922 . . . . 0.26 112.492 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.574 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 24.7 p-10 -61.44 -40.25 93.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.672 0.272 . . . . 0.91 111.112 -179.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 87.2 tttt -72.06 -41.68 67.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.364 -0.38 . . . . 3.19 110.657 -178.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.574 ' HB3' HD12 ' A' ' 34' ' ' ILE . 13.8 mmmt -64.67 -27.72 69.12 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.114 -0.234 . . . . 2.45 111.365 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.4 ' O ' ' HG ' ' A' ' 43' ' ' LEU . . . -67.34 -40.2 85.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.053 0.454 . . . . 0.29 109.904 174.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 36' ' ' ASN . 45.3 mm -70.08 -40.13 78.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.079 176.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 15.5 mm-40 -58.65 -43.25 89.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.841 -0.618 . . . . 2.1 110.395 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.75 HD22 ' HB3' ' A' ' 73' ' ' LEU . 34.8 mt -59.98 -33.76 72.39 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.254 -0.43 . . . . 0.29 110.846 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.564 HD21 HG23 ' A' ' 15' ' ' ILE . 63.1 mt -62.91 -32.42 73.7 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.879 -0.328 . . . . 1.36 110.553 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.7 mmm -76.97 -39.64 49.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.935 0.398 . . . . 2.2 110.072 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.8 mt-10 -60.5 -27.18 67.39 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.699 -0.682 . . . . 1.83 111.501 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.556 HG23 ' O ' ' A' ' 42' ' ' LEU . 72.4 p -56.86 -37.48 71.38 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-O 120.607 0.241 . . . . 1.03 110.806 177.727 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -60.67 -37.58 82.06 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.057 -0.52 . . . . 0.88 111.754 -173.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.57 -37.2 82.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.939 0.399 . . . . 2.51 110.03 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.757 HG12 HH12 ' A' ' 64' ' ' ARG . 61.4 t -76.28 -32.65 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.023 0.44 . . . . 0.76 110.194 176.169 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.983 ' HA ' HH22 ' A' ' 64' ' ' ARG . 33.3 mm-40 -59.64 -48.56 81.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 1.96 111.541 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -69.89 -21.52 63.31 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.984 0.365 . . . . 2.25 111.984 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -96.99 -25.84 15.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.964 0.411 . . . . 2.34 112.001 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.27 45.62 14.52 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 116.011 -0.54 . . . . 1.33 113.506 176.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -102.29 129.01 9.74 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.488 -0.863 . . . . 0.89 114.5 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.925 HD13 ' HB2' ' A' ' 72' ' ' ASN . 58.9 tp -176.58 127.77 0.19 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.229 0.538 . . . . 1.38 112.16 165.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -121.33 108.88 14.23 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.563 -1.273 . . . . 2.87 107.563 162.249 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.956 HG22 " H4'" ' P' ' 600' ' ' ' A' . 0.9 OUTLIER -80.89 -174.93 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.426 -0.352 . . . . 0.68 111.904 -174.102 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.827 ' HE3' " O3'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -55.82 -33.46 64.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.68 0.622 . . . . 0.91 112.68 -173.156 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -89.65 -36.46 15.24 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.179 -0.608 . . . . 2.28 112.166 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.85 -15.34 32.36 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.734 -0.547 . . . . 1.21 111.734 -175.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.0 m -72.58 -59.85 2.52 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.32 0.581 . . . . 2.18 110.961 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -85.09 145.69 27.52 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 106.255 -1.757 . . . . 2.89 106.255 167.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -132.27 130.97 41.59 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 119.358 -0.937 . . . . 3.59 110.645 -177.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.983 HH22 ' HA ' ' A' ' 50' ' ' GLU . 9.2 tpt180 69.95 88.13 0.11 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.932 0.872 . . . . 1.98 112.359 172.686 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.764 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.3 t -110.37 147.49 36.46 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.83 -1.077 . . . . 0.44 109.072 172.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -45.25 -58.85 1.38 Allowed 'Trans proline' 0 N--CA 1.486 1.077 0 C-N-CA 123.939 3.093 . . . . 0.44 113.29 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 1.07 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -63.46 -42.29 99.04 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 110.545 -1.022 . . . . 0.25 110.545 176.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.764 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.56 -28.93 56.91 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.667 -0.767 . . . . 0.3 113.403 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.913 HG22 ' HD2' ' A' ' 64' ' ' ARG . 22.7 t -67.53 -36.67 77.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.199 0.523 . . . . 0.74 110.008 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.575 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 7.6 t80 -66.08 -37.31 85.46 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.792 -0.64 . . . . 0.26 109.438 171.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.22 -36.8 73.68 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 108.21 -1.033 . . . . 0.32 108.21 176.249 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.925 ' HB2' HD13 ' A' ' 55' ' ' LEU . 65.3 t30 -60.31 -30.91 69.8 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.133 -0.94 . . . . 1.08 110.302 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.75 ' HB3' HD22 ' A' ' 42' ' ' LEU . 50.5 mt -60.77 -39.53 89.15 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.831 -0.622 . . . . 0.46 112.008 -178.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.78 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.3 mp -57.68 -34.94 69.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.055 0.455 . . . . 1.08 110.807 -178.217 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.731 ' HG2' ' O ' ' A' ' 72' ' ' ASN . 0.3 OUTLIER -93.72 -6.02 47.13 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.209 -0.307 . . . . 1.93 110.828 -177.145 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -115.21 -27.87 7.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.516 -0.311 . . . . 2.12 111.759 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.529 HG23 ' HB ' ' A' ' 80' ' ' ILE . 13.8 t -58.0 117.68 21.29 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-O 122.011 0.91 . . . . 0.94 110.201 -177.385 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.1 Cg_exo -72.94 -15.71 26.16 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 123.511 2.808 . . . . 1.0 113.857 -161.11 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 40.0 t -105.96 5.5 30.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.672 0.273 . . . . 1.49 111.649 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.529 ' HB ' HG23 ' A' ' 77' ' ' THR . 34.0 mm -115.78 139.26 43.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.616 0.246 . . . . 1.21 110.792 -176.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.495 ' O ' HG12 ' A' ' 85' ' ' ILE . 39.2 t -78.68 140.96 38.3 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.204 0.526 . . . . 1.79 110.863 -177.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.29 -34.47 78.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 114.92 -1.036 . . . . 2.89 111.949 -175.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.78 -43.66 98.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.116 0.484 . . . . 2.06 110.551 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.15 -28.53 70.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.56 -0.746 . . . . 2.31 110.398 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.78 HG23 ' HB3' ' A' ' 74' ' ' LEU . 47.1 mm -69.88 -34.42 60.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.19 -0.914 . . . . 1.41 111.461 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.535 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.7 tmmm? -58.78 -34.85 71.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.093 0.473 . . . . 2.45 110.215 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.88 -31.31 67.93 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.922 -0.581 . . . . 1.7 111.087 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.843 HG12 HD12 ' A' ' 33' ' ' ILE . 34.8 mt -68.72 -67.82 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.625 0.602 . . . . 0.42 112.625 -173.137 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.539 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -112.29 -9.28 13.89 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.515 0.931 . . . . 0.75 113.515 -169.315 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.539 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 82.7 t80 -87.91 -24.87 23.5 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.076 0.465 . . . . 1.13 110.751 -174.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.439 HG22 ' O ' ' A' ' 91' ' ' ILE . 24.2 mt -85.96 2.72 4.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.797 0.808 . . . . 0.86 109.864 177.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.588 ' OE2' ' HG ' ' A' ' 26' ' ' LEU . 45.7 tt0 -60.21 -27.61 67.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.145 -0.934 . . . . 2.67 111.519 -178.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -75.81 -60.8 2.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 4.7 111.643 -176.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.726 HE22 ' HB3' ' A' ' 97' ' ' TYR . 0.0 OUTLIER 65.75 99.82 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.261 0.553 . . . . 3.67 111.695 -177.941 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -135.97 145.14 45.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.012 -0.54 . . . . 7.97 110.5 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 60.93 21.51 11.76 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.795 -0.638 . . . . 7.59 111.552 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' TYR . . . . . 0.726 ' HB3' HE22 ' A' ' 94' ' ' GLN . 14.8 t80 -151.24 -68.8 0.18 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.222 -0.659 . . . . 8.84 109.222 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.447 ' H ' ' NE2' ' A' ' 94' ' ' GLN . 33.2 mt-10 56.87 50.3 12.6 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 123.682 0.614 . . . . 10.06 111.3 169.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -119.35 -22.96 6.86 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.895 -0.593 . . . . 12.32 111.072 -174.282 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -83.16 71.52 10.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.195 0.522 . . . . 14.02 111.396 -175.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -89.98 89.92 7.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 15.92 110.756 177.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -90.35 -96.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.591 -0.277 . . . . 17.13 110.297 177.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -92.41 -11.67 34.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.624 0.726 . . . . 18.06 109.764 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 . . . . . 0 C--O 1.246 0.9 0 CA-C-N 114.93 -1.032 . . . . 19.51 108.984 179.279 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' P' P ' 600' ' ' ' A' . . . . . 0.956 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.424 -0.997 1 C3'-C2'-C1' 97.849 -4.057 . 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 601' ' ' ' U' . . . . . 0.827 " O3'" ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.511 -1.27 1 C4'-C3'-C2' 96.523 -6.177 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 004 nuclear build full ' P' P ' 602' ' ' ' C' . . . . . 0.635 " O2'" " H3'" ' P' ' 603' ' ' ' G' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 O4'-C4'-C3' 103.078 -1.73 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' P' P ' 603' ' ' ' G' . . . . . 0.635 " H3'" " O2'" ' P' ' 602' ' ' ' C' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C4'-C3'-C2' 103.474 0.774 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.199 -0.36 . . . . 9.19 112.199 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.49 -48.19 61.44 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.477 -0.564 . . . . 7.69 109.477 175.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 75.6 mmm -132.16 -83.66 0.49 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.334 -0.848 . . . . 7.18 109.378 170.276 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 42.69 51.14 5.04 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 124.02 0.825 . . . . 4.5 111.694 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -77.73 145.27 36.63 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.387 0.613 . . . . 4.1 110.801 -177.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.423 ' HB3' HG13 ' A' ' 40' ' ' ILE . 5.1 p30 -92.42 57.13 2.91 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.439 -0.801 . . . . 1.79 111.14 -178.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB2' ' HB3' ' A' ' 10' ' ' LYS . 0.3 OUTLIER -63.24 119.28 9.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.663 -0.495 . . . . 1.33 109.663 175.628 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.465 ' CD ' ' H ' ' A' ' 8' ' ' GLN . 21.6 mp0 -49.54 -47.97 48.67 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.098 0.407 . . . . 1.88 112.098 -167.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.83 -51.09 63.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.822 0.344 . . . . 2.17 110.915 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 7' ' ' SER . 34.3 tttm -55.28 -48.11 74.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.725 -0.67 . . . . 2.55 110.793 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.778 ' O ' HG12 ' A' ' 15' ' ' ILE . 72.2 t -60.33 -53.41 49.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.845 -0.616 . . . . 0.39 110.302 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB1' ' CB ' ' A' ' 28' ' ' ALA . . . -53.86 -39.29 65.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.261 0.553 . . . . 0.35 111.256 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.43 -45.46 76.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.494 -0.775 . . . . 0.86 110.625 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.57 ' HG2' ' HA ' ' A' ' 11' ' ' VAL . 15.4 pt-20 -76.39 -26.54 55.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.151 -0.477 . . . . 2.05 112.06 -176.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.778 HG12 ' O ' ' A' ' 11' ' ' VAL . 28.3 mm -56.34 -53.75 36.26 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 N-CA-C 108.946 -0.761 . . . . 0.33 108.946 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.673 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 22.0 p -66.52 -33.87 76.64 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.148 -0.933 . . . . 0.32 111.076 -178.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . 0.408 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 74.0 t80 -58.61 -41.7 86.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.054 -0.521 . . . . 0.59 110.451 175.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 52.7 mtt180 -77.74 -31.97 52.44 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.351 -0.386 . . . . 2.83 110.859 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.463 HD23 ' N ' ' A' ' 19' ' ' LEU . 0.7 OUTLIER -82.67 -20.48 36.11 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.068 -0.515 . . . . 0.99 111.629 -174.688 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 58.64 33.93 23.45 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.12 -1.067 . . . . 1.6 108.12 -164.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.673 ' HB2' ' HA ' ' A' ' 16' ' ' SER . 0.3 OUTLIER -61.58 130.68 92.27 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 113.375 -1.739 . . . . 1.31 112.396 -173.203 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 88.2 Cg_endo -72.57 -33.04 8.99 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 124.125 3.217 . . . . 0.41 113.47 172.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.526 ' HD3' ' OE2' ' A' ' 92' ' ' GLU . 42.6 pttt -113.35 67.81 0.67 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.084 0.945 . . . . 1.41 109.679 -174.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -66.16 -17.8 64.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.32 -1.309 . . . . 1.75 111.49 -172.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -76.19 -39.39 54.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.316 -0.402 . . . . 2.14 110.359 175.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.5 HD13 ' HD2' ' A' ' 23' ' ' LYS . 5.2 tt -73.58 -36.49 65.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.797 -0.446 . . . . 1.33 109.797 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.574 HG21 ' HB3' ' A' ' 16' ' ' SER . 1.9 tp -65.77 -27.51 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.626 -0.509 . . . . 0.44 109.626 176.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.707 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.3 -34.57 63.54 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.318 0.58 . . . . 0.21 110.363 171.635 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 16.7 ttm180 -61.37 -47.82 84.1 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.498 -0.774 . . . . 1.48 111.5 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.715 ' O ' HG12 ' A' ' 34' ' ' ILE . 12.7 p -58.49 -37.26 63.35 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.082 0 N-CA-C 109.73 -0.47 . . . . 1.1 109.73 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.707 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 41.1 t -52.57 -53.57 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.426 -0.807 . . . . 0.22 110.371 173.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.87 -42.41 99.75 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.347 -0.842 . . . . 3.75 111.052 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.596 HD12 HG12 ' A' ' 88' ' ' ILE . 32.7 mt -75.38 -52.15 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 113.312 0.856 . . . . 0.8 113.312 -174.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.715 HG12 ' O ' ' A' ' 30' ' ' VAL . 31.4 pt -82.3 -21.99 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.195 -0.602 . . . . 0.4 111.083 -176.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.33 146.45 9.24 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.584 -0.817 . . . . 0.26 111.438 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.433 ' O ' HG12 ' A' ' 40' ' ' ILE . 9.8 p-10 -63.42 -40.3 96.82 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 122.394 0.278 . . . . 0.91 111.519 -177.381 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.79 ' HD2' ' H ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -72.26 -34.01 67.92 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.802 -0.359 . . . . 3.19 110.991 178.694 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.671 ' HG3' HD12 ' A' ' 34' ' ' ILE . 14.6 tppt? -61.7 -42.0 98.35 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 110.145 -0.317 . . . . 2.45 110.145 176.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.463 ' O ' HD22 ' A' ' 43' ' ' LEU . . . -60.44 -42.39 96.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.051 -0.522 . . . . 0.29 110.49 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 36' ' ' ASN . 41.9 mm -61.37 -42.6 94.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.625 177.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 37' ' ' LYS . 46.9 mt-10 -61.22 -38.23 85.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.236 -0.438 . . . . 2.1 110.429 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.962 HD22 ' HB3' ' A' ' 73' ' ' LEU . 75.3 mt -65.41 -31.04 71.93 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.105 -0.498 . . . . 0.29 111.378 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.659 HD21 HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -62.35 -28.93 70.1 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.922 -0.486 . . . . 1.36 110.793 175.898 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.8 mtp -75.4 -35.21 61.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.322 0.582 . . . . 2.2 109.794 171.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.597 ' HB2' HD13 ' A' ' 73' ' ' LEU . 11.0 mm-40 -70.04 -26.8 64.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.536 -0.756 . . . . 1.83 111.461 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 43.3 p -57.01 -47.58 80.53 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.365 -0.606 . . . . 1.03 109.365 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -64.57 -35.81 82.18 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.837 -0.619 . . . . 0.88 110.914 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.668 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 21.9 tp10 -59.2 -49.3 78.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.925 -0.579 . . . . 2.51 109.566 176.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 79.7 t -70.58 -33.38 53.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.184 -0.462 . . . . 0.76 110.821 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.733 ' HA ' HH22 ' A' ' 64' ' ' ARG . 6.4 mm-40 -59.94 -34.48 73.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.6 -0.273 . . . . 1.96 111.612 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.668 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.1 pt20 -83.1 -24.03 32.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 2.25 110.644 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -88.8 -27.59 21.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 2.34 111.176 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.58 50.27 38.26 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 115.745 -0.661 . . . . 1.33 113.352 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.428 ' N ' ' HE ' ' A' ' 64' ' ' ARG . . . -132.28 121.24 2.94 Favored Glycine 0 C--O 1.223 -0.55 0 C-N-CA 119.706 -1.235 . . . . 0.89 114.225 -177.006 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 1.038 HD11 HG23 ' A' ' 57' ' ' ILE . 1.9 tm? -165.23 125.51 1.88 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.885 0.374 . . . . 1.38 110.165 171.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.525 ' N ' HD22 ' A' ' 55' ' ' LEU . 90.1 m-85 -119.16 113.73 21.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.77 -0.826 . . . . 2.87 108.77 171.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.038 HG23 HD11 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -87.37 -161.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.72 -0.673 . . . . 0.68 111.976 -175.493 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.748 ' HG3' " C3'" ' P' ' 601' ' ' ' U' . 3.2 mtt -44.49 -48.71 10.1 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 123.759 0.662 . . . . 0.91 110.949 -175.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -107.98 -28.32 9.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.738 -0.665 . . . . 2.28 111.338 177.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.88 -18.84 37.14 Favored Glycine 0 C--O 1.224 -0.505 0 C-N-CA 120.853 -0.689 . . . . 1.21 112.888 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.5 m -56.76 -45.95 81.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.161 0.43 . . . . 2.18 112.161 178.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.534 ' HD3' ' OP2' ' P' ' 602' ' ' ' C' . 35.2 mtp180 -84.43 43.17 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.932 0.873 . . . . 2.89 109.326 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 63' ' ' ARG . 38.4 ttp180 -47.01 130.06 12.17 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 113.552 -1.658 . . . . 3.59 112.611 -170.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.733 HH22 ' HA ' ' A' ' 50' ' ' GLU . 0.1 OUTLIER 64.13 71.82 0.47 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.248 -0.887 . . . . 1.98 112.822 -178.274 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.833 HG23 ' HA3' ' A' ' 68' ' ' GLY . 3.1 t -90.49 140.76 26.88 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 107.973 -1.121 . . . . 0.44 107.973 166.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -47.7 -58.16 1.9 Allowed 'Trans proline' 0 N--CA 1.48 0.72 0 C-N-CA 123.581 2.854 . . . . 0.44 113.262 -171.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.658 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -69.29 -40.33 81.07 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.284 -0.96 . . . . 0.25 111.245 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.833 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -55.97 -28.2 52.75 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.515 -0.342 . . . . 0.3 113.075 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.73 HG22 ' HD2' ' A' ' 64' ' ' ARG . 70.4 t -63.09 -39.02 83.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.144 0.497 . . . . 0.74 110.69 176.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.443 ' CG ' HD11 ' A' ' 19' ' ' LEU . 6.9 t80 -66.32 -34.84 78.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.219 -0.446 . . . . 0.26 110.022 172.06 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.677 ' HG ' ' HA2' ' A' ' 68' ' ' GLY . 0.1 OUTLIER -55.3 -33.52 63.35 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 108.658 -0.867 . . . . 0.32 108.658 176.705 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.847 ' HB2' HD23 ' A' ' 55' ' ' LEU . 27.8 t-20 -56.06 -40.53 73.68 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.954 -0.566 . . . . 1.08 109.976 174.135 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.962 ' HB3' HD22 ' A' ' 42' ' ' LEU . 34.5 mt -67.91 -38.15 82.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.599 -0.728 . . . . 0.46 111.031 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.669 ' O ' HD12 ' A' ' 85' ' ' ILE . 5.0 tt -57.56 -38.95 75.63 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.817 -1.083 . . . . 1.08 109.734 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.686 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 12.6 pttt -93.89 -31.22 14.41 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.757 0.651 . . . . 1.93 112.757 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 72' ' ' ASN . 8.1 m-20 -97.28 19.97 12.26 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.838 0.31 . . . . 2.12 111.838 -174.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.681 HG21 HD12 ' A' ' 80' ' ' ILE . 4.1 t -68.44 120.2 73.48 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 109.118 -0.697 . . . . 0.94 109.118 172.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.516 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 9.3 Cg_exo -71.8 -9.47 24.87 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 123.077 2.518 . . . . 1.0 114.029 -166.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 77.3 p -111.23 1.25 17.09 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.118 0.414 . . . . 1.49 112.118 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.681 HD12 HG21 ' A' ' 77' ' ' THR . 47.3 mt -119.93 140.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 1.21 111.493 -175.859 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' SER . . . . . 0.416 ' O ' HG12 ' A' ' 85' ' ' ILE . 23.3 t -82.46 154.75 24.97 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.566 0.698 . . . . 1.79 111.003 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.427 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 27.9 tt0 -60.71 -34.06 73.81 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.466 -1.243 . . . . 2.89 113.182 -167.911 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -63.0 -46.91 85.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.842 0.312 . . . . 2.06 111.842 -175.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.96 -32.55 72.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.209 0.528 . . . . 2.31 109.997 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.669 HD12 ' O ' ' A' ' 74' ' ' LEU . 30.8 mm -61.57 -44.93 99.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.169 -0.923 . . . . 1.41 110.963 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.58 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 36.4 ttpt -57.25 -40.69 78.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.505 -0.77 . . . . 2.45 111.516 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.92 -31.34 72.53 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.778 -0.646 . . . . 1.7 110.971 -174.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.596 HG12 HD12 ' A' ' 33' ' ' ILE . 44.8 mt -70.0 -71.37 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.601 0.593 . . . . 0.42 112.601 -175.064 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.509 ' CD1' HD13 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -110.57 -15.7 13.82 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.419 0.896 . . . . 0.75 113.419 -168.368 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 81.7 t80 -71.58 -27.32 63.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.378 0.608 . . . . 1.13 110.614 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 43.2 mt -72.51 -9.81 13.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.467 -0.788 . . . . 0.86 111.174 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLU . . . . . 0.526 ' OE2' ' HD3' ' A' ' 23' ' ' LYS . 50.3 tt0 -61.82 -44.14 97.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.66 0.267 . . . . 2.67 111.099 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -103.7 -38.13 7.21 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.786 -0.365 . . . . 4.7 111.326 -178.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 62.0 -78.29 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.171 0.588 . . . . 3.67 112.296 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -150.53 103.17 3.1 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.443 -0.577 . . . . 7.97 109.443 -178.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -92.1 120.06 32.36 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.645 0.736 . . . . 7.59 112.11 -172.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -81.83 81.72 7.75 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.698 -1.137 . . . . 8.84 110.954 171.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 75.5 tt0 -117.0 142.63 46.7 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.294 -0.632 . . . . 10.06 109.294 178.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.529 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . 0.9 OUTLIER -89.65 -35.08 16.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.99 0.367 . . . . 12.32 111.99 -175.128 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm 61.41 26.15 15.97 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.691 -0.686 . . . . 14.02 112.335 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.529 ' HG3' ' HB3' ' A' ' 99' ' ' ASN . 33.8 mtmm -81.01 54.44 2.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.188 0.518 . . . . 15.92 110.472 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -110.72 119.3 38.68 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.205 -0.452 . . . . 17.13 110.862 -177.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.78 80.25 0.21 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.623 -0.717 . . . . 18.06 112.329 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.801 -0.618 . . . . 19.51 109.653 174.796 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' P' P ' 600' ' ' ' A' . . . . . 0.766 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.515 -0.945 1 C3'-C2'-C1' 97.801 -4.11 . 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 601' ' ' ' U' . . . . . 0.748 " C3'" ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.507 -1.624 1 C4'-C3'-C2' 95.84 -6.86 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 005 nuclear build full ' P' P ' 602' ' ' ' C' . . . . . 0.534 ' OP2' ' HD3' ' A' ' 62' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.989 0 C3'-C2'-C1' 100.394 -1.229 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.909 0 O4'-C1'-N19 108.971 0.771 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.784 0 N-CA-C 112.222 -0.351 . . . . 9.19 112.222 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.7 165.61 11.04 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 110.178 -0.304 . . . . 7.69 110.178 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 63.5 mtm -97.54 69.14 2.18 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.583 -0.525 . . . . 7.18 109.583 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.64 59.63 0.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.715 -0.675 . . . . 4.5 110.897 -176.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -70.43 -29.09 65.6 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.095 -0.706 . . . . 4.1 109.095 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.404 ' HB3' HD12 ' A' ' 40' ' ' ILE . 6.5 p-10 -76.91 73.25 3.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.051 -0.977 . . . . 1.79 110.69 176.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.48 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.2 m -72.28 130.37 40.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.317 -0.856 . . . . 1.33 110.27 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.569 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 52.5 mt-30 -47.91 -47.6 32.11 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.275 0.843 . . . . 1.88 113.275 -169.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -67.69 -39.15 84.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.751 0.31 . . . . 2.17 111.259 -176.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -70.11 -36.43 74.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.429 -0.35 . . . . 2.55 110.576 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.667 ' O ' HG12 ' A' ' 15' ' ' ILE . 85.9 t -58.14 -41.38 80.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.194 -0.457 . . . . 0.39 110.794 177.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -44.27 82.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.029 0.443 . . . . 0.35 111.157 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.06 -33.78 72.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.977 -0.556 . . . . 0.86 110.203 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -63.01 -43.9 97.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.645 -0.707 . . . . 2.05 110.647 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.704 HD13 HD11 ' A' ' 43' ' ' LEU . 5.0 mm -64.72 -51.0 72.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 N-CA-C 109.894 -0.41 . . . . 0.33 109.894 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.661 ' HB3' HG21 ' A' ' 27' ' ' ILE . 16.3 p -62.98 -40.55 98.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.32 111.267 -174.604 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -61.92 -45.16 94.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.59 111.178 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -74.2 -34.23 63.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.748 0.308 . . . . 2.83 111.785 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.477 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 29.1 mt -82.49 -13.84 56.01 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.441 -0.345 . . . . 0.99 111.915 -176.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 68.6 mt-30 61.51 32.04 18.85 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 108.333 -0.988 . . . . 1.6 108.333 -170.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.732 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 7.6 tp10 -59.39 116.44 16.29 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 114.135 -1.393 . . . . 1.31 112.171 -172.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.519 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 59.9 Cg_endo -67.07 -46.58 2.99 Favored 'Trans proline' 0 N--CA 1.472 0.26 0 C-N-CA 124.066 3.177 . . . . 0.41 113.049 173.005 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.636 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 41.7 pttt -100.88 67.91 1.25 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.737 0.779 . . . . 1.41 109.894 -175.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.33 -17.95 56.25 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.128 -0.942 . . . . 1.75 112.255 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -57.54 -40.74 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 2.14 110.182 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.667 HD21 ' HA ' ' A' ' 89' ' ' PHE . 3.2 tm? -73.02 -45.52 57.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.396 -0.82 . . . . 1.33 110.334 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.732 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.0 tp -68.05 -28.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.997 -0.547 . . . . 0.44 111.083 -175.022 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.625 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.45 -34.67 60.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.41 . . . . 0.21 110.563 172.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.46 ' O ' HG12 ' A' ' 33' ' ' ILE . 12.6 ttm180 -63.08 -45.98 89.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 1.48 111.476 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 34' ' ' ILE . 12.5 p -55.64 -38.69 51.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.094 0.473 . . . . 1.1 109.878 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.625 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 65.3 t -54.87 -50.64 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.167 -0.924 . . . . 0.22 110.571 173.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.09 -40.81 95.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.141 -0.936 . . . . 3.75 110.959 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.625 HG13 HG12 ' A' ' 88' ' ' ILE . 39.1 mm -74.42 -48.54 35.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 115.993 -0.549 . . . . 0.8 112.236 -175.726 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 30' ' ' VAL . 32.0 pt -91.33 -29.1 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 120.379 -0.529 . . . . 0.4 112.288 -174.392 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.15 161.88 11.83 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.561 -0.828 . . . . 0.26 112.612 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.569 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 2.5 p-10 -65.07 -52.67 54.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.785 0.326 . . . . 0.91 111.72 -178.279 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -71.63 -32.9 68.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.924 0.392 . . . . 3.19 110.396 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -67.8 -29.91 69.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 2.45 111.056 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.69 -39.99 84.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 0.29 110.178 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.404 HD12 ' HB3' ' A' ' 6' ' ' ASP . 30.2 mt -69.34 -32.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.517 . . . . 1.13 110.911 176.644 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -58.72 -38.55 78.58 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.099 -0.334 . . . . 2.1 110.099 173.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.845 ' HB3' HD13 ' A' ' 73' ' ' LEU . 68.4 mt -71.41 -35.2 70.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.431 -0.35 . . . . 0.29 110.204 174.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.704 HD11 HD13 ' A' ' 15' ' ' ILE . 41.1 mt -63.99 -29.93 71.05 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.201 0.524 . . . . 1.36 111.545 176.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.8 tpp -75.97 -35.32 59.7 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.327 0.584 . . . . 2.2 109.684 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -69.87 -34.38 73.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.292 -0.867 . . . . 1.83 111.501 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' THR . . . . . 1.086 HG23 HD11 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -52.0 -36.61 50.42 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 112.097 0.406 . . . . 1.03 112.097 -176.451 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.51 85.4 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.628 0.233 . . . . 0.88 111.628 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.45 -30.6 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.402 0.62 . . . . 2.51 110.276 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.1 t -76.38 -44.86 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.363 -0.835 . . . . 0.76 110.546 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -56.14 -49.03 75.08 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.225 -0.898 . . . . 1.96 112.218 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 19.7 pt20 -60.75 -29.37 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 2.25 111.906 -173.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -91.75 -25.22 19.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.976 0.417 . . . . 2.34 111.636 -177.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.08 -14.63 18.97 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.21 -0.519 . . . . 1.33 112.104 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 40.31 -81.91 0.0 OUTLIER Glycine 0 CA--C 1.528 0.899 0 N-CA-C 117.657 1.823 . . . . 0.89 117.657 167.249 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 1.059 HD11 HG23 ' A' ' 57' ' ' ILE . 2.8 tm? -74.85 132.01 41.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 115.252 1.575 . . . . 1.38 115.252 -156.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.57 ' N ' HD22 ' A' ' 55' ' ' LEU . 74.3 t80 -123.34 114.19 19.85 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.425 -1.261 . . . . 2.87 107.644 159.158 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.059 HG23 HD11 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -87.61 -172.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 114.125 1.158 . . . . 0.68 114.125 -168.611 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.843 ' HE3' " O3'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -55.39 -47.26 76.12 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 115.174 -0.921 . . . . 0.91 112.754 -172.056 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 24.4 p30 -91.62 -27.72 17.96 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 119.776 -0.77 . . . . 2.28 111.468 176.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.424 ' HA3' ' CZ ' ' A' ' 56' ' ' PHE . . . 82.61 -13.44 41.71 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.904 -0.665 . . . . 1.21 113.768 176.24 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.2 m -46.37 -58.48 3.69 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 122.89 0.476 . . . . 2.18 111.833 -177.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HG3' HD11 ' A' ' 57' ' ' ILE . 3.5 ptp180 -99.89 104.71 16.38 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.223 -0.658 . . . . 2.89 109.223 173.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -72.57 127.18 31.78 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.563 -0.455 . . . . 3.59 110.502 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.756 ' HA ' ' HB3' ' A' ' 55' ' ' LEU . 8.9 tpt85 71.22 98.74 0.07 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.968 -1.014 . . . . 1.98 112.814 175.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' THR . . . . . 1.003 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.1 t -109.31 147.85 36.83 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 114.268 -1.333 . . . . 0.44 108.862 168.241 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -51.51 -59.05 1.27 Allowed 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.124 2.55 . . . . 0.44 113.076 -175.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.586 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -66.22 -36.27 91.55 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.294 -0.955 . . . . 0.25 110.721 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 1.003 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.18 -32.06 59.74 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.911 -0.645 . . . . 0.3 112.927 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.675 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 0.4 OUTLIER -65.26 -32.57 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 117.459 0.63 . . . . 0.74 110.101 -178.683 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.57 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 18.6 t80 -67.42 -37.67 83.41 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.571 -0.529 . . . . 0.26 109.571 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.586 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -62.37 -34.78 77.36 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.381 -1.34 . . . . 0.32 107.381 176.549 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.733 ' HB2' HD23 ' A' ' 55' ' ' LEU . 65.7 t30 -59.67 -31.4 69.51 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 115.19 -0.914 . . . . 1.08 109.852 175.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 1.086 HD11 HG23 ' A' ' 46' ' ' THR . 87.8 mt -62.02 -33.1 73.73 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 115.683 -0.69 . . . . 0.46 111.956 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.665 ' HB3' HG23 ' A' ' 85' ' ' ILE . 42.1 mt -64.32 -21.28 66.56 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.381 -0.528 . . . . 1.08 110.395 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.519 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -85.19 -15.29 44.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 1.93 110.641 173.468 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -115.02 4.45 14.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 2.12 111.428 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.62 HG23 ' HB ' ' A' ' 80' ' ' ILE . 9.7 t -72.93 114.34 29.82 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 121.758 0.79 . . . . 0.94 109.968 -175.496 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 6.2 Cg_exo -72.94 -22.16 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 123.039 2.492 . . . . 1.0 113.499 -165.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 30.2 m -112.85 17.4 19.01 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.09 0.774 . . . . 1.49 113.09 -173.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.62 ' HB ' HG23 ' A' ' 77' ' ' THR . 41.0 mm -118.3 135.9 57.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.115 0.484 . . . . 1.21 111.724 -177.157 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.3 p -75.89 148.91 37.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.743 -0.662 . . . . 1.79 110.344 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -57.06 -34.48 68.3 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.848 -1.069 . . . . 2.89 112.962 -169.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -70.29 -42.69 71.72 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.144 -0.222 . . . . 2.06 111.309 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.597 ' O ' HG13 ' A' ' 88' ' ' ILE . 91.7 mt-30 -60.93 -34.46 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.934 0.397 . . . . 2.31 110.13 177.197 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.665 HG23 ' HB3' ' A' ' 74' ' ' LEU . 60.4 mt -60.69 -51.15 76.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 1.41 110.049 175.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.555 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 27.1 ttpt -54.64 -42.47 71.29 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.831 -0.622 . . . . 2.45 110.512 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.44 -35.96 79.03 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.183 -0.917 . . . . 1.7 111.714 -175.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.625 HG12 HG13 ' A' ' 33' ' ' ILE . 62.9 mt -70.94 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 112.273 0.471 . . . . 0.42 112.273 -177.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.667 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -103.4 -18.9 14.63 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.613 0.968 . . . . 0.75 113.613 -166.683 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.555 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 60.4 t80 -77.05 -38.94 51.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.864 0.364 . . . . 1.13 110.632 -175.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.58 ' HA ' ' HB2' ' A' ' 94' ' ' GLN . 43.4 mt -68.49 -17.05 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.251 0.548 . . . . 0.86 110.843 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -66.71 -33.5 75.77 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.58 -0.526 . . . . 2.67 109.58 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -85.83 -36.58 19.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.207 0.527 . . . . 4.7 109.971 175.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.58 ' HB2' ' HA ' ' A' ' 91' ' ' ILE . 15.5 mm100 -78.87 78.25 5.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.487 -0.779 . . . . 3.67 111.756 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -85.82 -49.55 7.82 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.05 -0.523 . . . . 7.97 109.742 175.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 60.7 tt0 54.56 93.43 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.707 0.629 . . . . 7.59 112.497 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -117.48 136.98 52.84 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.857 -0.423 . . . . 8.84 109.857 177.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.1 mp0 -81.11 141.14 34.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.374 -0.376 . . . . 10.06 110.113 178.132 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -135.87 27.61 3.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.414 -0.357 . . . . 12.32 111.352 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -126.46 30.13 5.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.423 -0.353 . . . . 14.02 111.357 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt 66.83 84.38 0.16 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.834 -0.621 . . . . 15.92 111.417 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -100.95 84.74 2.73 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.981 -0.554 . . . . 17.13 109.824 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.04 112.94 5.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 18.06 111.148 -178.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.664 -0.684 . . . . 19.51 109.193 179.76 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' P' P ' 600' ' ' ' A' . . . . . 0.887 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.515 -0.904 0 C3'-C2'-C1' 98.095 -3.784 . 0.0 '__' . 2.3 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' P' P ' 601' ' ' ' U' . . . . . 0.843 " O3'" ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.509 -1.474 1 C4'-C3'-C2' 96.488 -6.212 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 006 nuclear build full ' P' P ' 602' ' ' ' C' . . . . . 0.74 ' O2 ' " H2'" ' P' ' 602' ' ' ' C' . . . . . . . . 0 O5'--C5' 1.429 -0.719 0 P-O3'-C3' 121.855 1.795 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C3'-C2'-C1' 100.742 -0.843 . 0.0 OUTLIER gamma 7.45 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.809 0 N-CA-C 112.058 -0.417 . . . . 9.19 112.058 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -121.95 110.1 15.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.711 0.291 . . . . 7.69 110.841 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -121.18 71.63 0.96 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.497 0.665 . . . . 7.18 111.053 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.05 43.66 1.19 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.851 -0.613 . . . . 4.5 109.541 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 63.57 -89.39 0.03 OUTLIER 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.158 -0.928 . . . . 4.1 110.464 -174.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -94.05 66.39 3.55 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.032 0.92 . . . . 1.79 109.33 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.415 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.8 m -58.95 128.55 37.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.873 -1.058 . . . . 1.33 110.242 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.809 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 49.9 mt-30 -53.23 -34.15 55.91 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.551 -0.75 . . . . 1.88 112.229 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.2 -48.21 68.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.833 0.349 . . . . 2.17 110.529 178.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -70.1 -35.85 74.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 2.55 110.727 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.696 ' O ' HG12 ' A' ' 15' ' ' ILE . 75.0 t -57.88 -56.49 15.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.05 -0.352 . . . . 0.39 110.05 176.639 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.43 -37.82 70.73 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.356 0.598 . . . . 0.35 110.962 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -61.57 -39.07 89.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.284 -0.871 . . . . 0.86 111.161 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HG2' ' HD2' ' A' ' 18' ' ' ARG . 33.3 tt0 -77.78 -41.2 38.21 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.034 0.383 . . . . 2.05 112.034 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.696 HG12 ' O ' ' A' ' 11' ' ' VAL . 7.0 mm -55.91 -50.85 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.029 0.443 . . . . 0.33 110.336 -175.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.645 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 7.8 p -57.59 -39.59 77.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.396 -0.82 . . . . 0.32 111.313 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -66.46 -45.58 79.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.116 -0.493 . . . . 0.59 110.88 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.406 ' HD2' ' HG2' ' A' ' 14' ' ' GLU . 34.2 mtp180 -65.42 -43.21 91.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.91 -0.586 . . . . 2.83 111.723 -175.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.589 HD12 ' HA2' ' A' ' 67' ' ' GLY . 3.3 mm? -83.05 -7.57 59.64 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.14 0.422 . . . . 0.99 112.14 -178.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 56.16 37.18 28.58 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.009 -1.108 . . . . 1.6 108.009 -169.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.788 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 5.5 tp10 -60.84 117.02 21.37 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 113.168 -1.833 . . . . 1.31 111.309 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.47 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 48.9 Cg_endo -64.16 -44.17 13.02 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 123.708 2.939 . . . . 0.41 112.862 174.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.689 ' HE2' ' C5 ' ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -104.49 72.37 1.04 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.74 1.257 . . . . 1.41 110.014 -175.792 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.494 ' O ' HG22 ' A' ' 27' ' ' ILE . 31.6 mtmm -66.12 -18.38 65.31 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.565 -1.652 . . . . 1.75 112.707 -167.389 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.21 -33.08 69.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.124 0.487 . . . . 2.14 109.732 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.903 HD11 ' HA ' ' A' ' 89' ' ' PHE . 8.7 tt -73.95 -40.51 63.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 1.33 110.26 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.788 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.9 tp -62.97 -29.73 47.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.651 -0.499 . . . . 0.44 109.651 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.656 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.37 -34.74 63.42 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.403 0.62 . . . . 0.21 110.285 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.9 ttm180 -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.556 -0.747 . . . . 1.48 111.125 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.67 ' O ' HG12 ' A' ' 34' ' ' ILE . 19.9 t -53.22 -46.37 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 N-CA-C 109.114 -0.698 . . . . 1.1 109.114 176.712 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.656 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -52.84 -50.33 43.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.153 -1.385 . . . . 0.22 111.337 175.374 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 -61.02 -49.7 76.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.733 -0.667 . . . . 3.75 111.627 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.581 HD12 HG12 ' A' ' 88' ' ' ILE . 35.8 mt -73.89 -51.94 22.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.713 0.634 . . . . 0.8 112.713 -171.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 30' ' ' VAL . 28.8 pt -83.81 -28.68 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.058 -0.657 . . . . 0.4 111.328 -176.142 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.97 149.8 8.64 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.596 -0.811 . . . . 0.26 111.66 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.809 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 1.6 p-10 -60.32 -41.34 93.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.078 0.399 . . . . 0.91 112.078 -177.33 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -71.79 -34.81 69.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.005 0.431 . . . . 3.19 110.237 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.849 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 21.5 mtpp -69.69 -25.03 63.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.122 -0.49 . . . . 2.45 110.992 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.64 -36.42 80.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.199 0.523 . . . . 0.29 109.606 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.41 -40.78 64.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.588 -0.733 . . . . 1.13 111.441 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.849 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 12.8 pt-20 -67.17 -31.81 72.48 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.726 -0.39 . . . . 2.1 110.443 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.823 ' HB3' HD13 ' A' ' 73' ' ' LEU . 28.6 mt -69.39 -41.91 75.84 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.349 -0.612 . . . . 0.29 109.349 171.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.62 -32.85 65.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.811 -0.631 . . . . 1.36 111.808 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 80.1 mtp -75.31 -42.36 54.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.136 0.493 . . . . 2.2 110.353 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -70.23 -25.05 63.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.799 -0.637 . . . . 1.83 111.369 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.566 HG23 HD11 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -56.04 -36.73 68.34 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 110.087 -0.338 . . . . 1.03 110.087 178.505 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.54 -34.4 77.83 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.075 -0.511 . . . . 0.88 110.975 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.639 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 43.9 mt-10 -71.12 -42.82 68.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.925 -0.58 . . . . 2.51 110.059 178.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.63 -33.39 63.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.013 -0.54 . . . . 0.76 109.813 176.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 3.7 tm-20 -61.66 -51.25 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.489 -0.778 . . . . 1.96 109.662 175.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.639 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.8 pt20 -64.84 -18.0 64.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.861 0.362 . . . . 2.25 111.3 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -99.06 -7.88 26.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.546 -0.297 . . . . 2.34 111.696 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.24 35.55 91.72 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 121.176 -0.535 . . . . 1.33 112.81 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -97.16 109.27 3.81 Favored Glycine 0 C--O 1.226 -0.358 0 C-N-CA 120.598 -0.81 . . . . 0.89 113.785 -174.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.914 HD11 HG23 ' A' ' 57' ' ' ILE . 2.6 tm? -176.82 124.47 0.15 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.122 0.487 . . . . 1.38 110.836 169.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.457 ' N ' HD22 ' A' ' 55' ' ' LEU . 97.2 m-85 -126.0 100.89 6.55 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.132 -1.062 . . . . 2.87 108.132 164.748 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.914 HG23 HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -72.03 -176.15 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.012 0.375 . . . . 0.68 112.012 -176.687 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.665 ' HE3' " H4'" ' P' ' 601' ' ' ' U' . 0.2 OUTLIER -41.22 -45.61 2.92 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.912 -1.04 . . . . 0.91 112.573 -179.414 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.707 ' ND2' ' HB2' ' A' ' 61' ' ' SER . 21.5 p-10 -94.92 -34.88 12.24 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.551 0.575 . . . . 2.28 112.551 -179.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.75 -17.08 32.77 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.422 -0.418 . . . . 1.21 113.181 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.707 ' HB2' ' ND2' ' A' ' 59' ' ' ASN . 68.6 m -64.12 -57.61 9.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.689 0.281 . . . . 2.18 111.683 -178.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.552 ' O ' HD11 ' A' ' 57' ' ' ILE . 68.7 ttt180 -81.59 81.55 7.63 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.907 -0.775 . . . . 2.89 108.907 174.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -71.41 126.96 31.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.774 -0.648 . . . . 3.59 111.167 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.752 ' HD2' HG22 ' A' ' 69' ' ' VAL . 0.1 OUTLIER 70.08 58.0 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.703 1.001 . . . . 1.98 113.703 172.618 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.804 HG21 " O2'" ' P' ' 601' ' ' ' U' . 3.7 t -78.64 143.33 62.95 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.221 -0.9 . . . . 0.44 109.152 169.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.433 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.3 Cg_endo -46.25 -59.61 1.15 Allowed 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 124.134 3.222 . . . . 0.44 113.477 -174.843 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.589 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -68.25 -34.55 80.74 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.329 -0.939 . . . . 0.25 111.316 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.763 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.31 -38.65 79.58 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 114.981 -0.61 . . . . 0.3 112.114 177.199 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.752 HG22 ' HD2' ' A' ' 64' ' ' ARG . 22.0 t -59.67 -41.44 85.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.129 0.49 . . . . 0.74 110.204 178.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.63 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 21.1 t80 -65.73 -36.83 84.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.26 110.484 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -57.63 -36.77 72.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.755 -0.831 . . . . 0.32 108.755 176.819 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.882 ' HB2' HD23 ' A' ' 55' ' ' LEU . 66.5 t30 -63.05 -27.7 69.59 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.453 -0.794 . . . . 1.08 110.549 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.823 HD13 ' HB3' ' A' ' 42' ' ' LEU . 45.5 mt -58.22 -35.41 71.63 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.148 -0.478 . . . . 0.46 111.763 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.861 ' HB3' HG23 ' A' ' 85' ' ' ILE . 7.2 mp -64.4 -19.78 65.72 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.089 -0.505 . . . . 1.08 110.616 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.542 ' HD3' ' C8 ' ' P' ' 600' ' ' ' A' . 0.0 OUTLIER -82.66 -40.11 21.16 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.927 0.394 . . . . 1.93 110.151 175.655 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -89.04 11.19 19.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.775 -0.648 . . . . 2.12 110.872 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.578 HG21 ' HB ' ' A' ' 80' ' ' ILE . 14.7 t -64.28 131.79 95.14 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 121.752 0.787 . . . . 0.94 109.946 -177.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.508 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.5 Cg_exo -72.72 -47.5 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.284 2.656 . . . . 1.0 113.851 -169.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.2 m -113.53 16.76 18.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.499 0.926 . . . . 1.49 113.499 -172.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.578 ' HB ' HG21 ' A' ' 77' ' ' THR . 61.4 mt -119.1 138.92 48.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.57 -0.452 . . . . 1.21 111.172 -174.739 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.3 p -98.28 167.2 11.0 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.063 0.458 . . . . 1.79 111.861 -177.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.455 ' H ' ' CD ' ' A' ' 82' ' ' GLU . 1.6 mp0 -51.9 -48.64 64.04 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.14 1.163 . . . . 2.89 114.14 -167.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -68.07 -37.09 80.86 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.567 -0.453 . . . . 2.06 111.796 -173.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.493 ' O ' HG13 ' A' ' 88' ' ' ILE . 43.1 mt-30 -62.22 -37.19 84.41 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.542 0.687 . . . . 2.31 109.26 175.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.861 HG23 ' HB3' ' A' ' 74' ' ' LEU . 82.4 mt -68.39 -49.49 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 114.637 -1.165 . . . . 1.41 110.934 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.546 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 39.3 ttmt -57.25 -41.45 79.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.887 -0.597 . . . . 2.45 111.538 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASP . . . . . 0.408 ' HA ' ' CD1' ' A' ' 91' ' ' ILE . 27.5 t70 -60.11 -32.92 71.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.005 0.431 . . . . 1.7 111.161 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.581 HG12 HD12 ' A' ' 33' ' ' ILE . 51.8 mt -70.83 -70.84 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.941 -0.572 . . . . 0.42 112.318 -177.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.903 ' HA ' HD11 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -106.89 -12.9 15.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 113.254 0.835 . . . . 0.75 113.254 -164.585 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.546 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 76.3 t80 -90.28 -38.14 13.6 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.793 0.33 . . . . 1.13 110.911 -172.809 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.613 HG23 ' HB3' ' A' ' 94' ' ' GLN . 51.4 mt -69.25 -64.0 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.426 -0.352 . . . . 0.86 110.423 178.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 51.81 -90.92 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.783 0.833 . . . . 2.67 112.286 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.0 m-20 -86.38 -22.1 26.81 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.131 -0.486 . . . . 4.7 111.434 -173.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLN . . . . . 0.613 ' HB3' HG23 ' A' ' 91' ' ' ILE . 16.9 tt0 -56.71 128.56 37.08 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.153 0.501 . . . . 3.67 111.17 -174.255 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -100.45 111.29 23.53 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.538 -0.755 . . . . 7.97 110.453 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -92.86 -44.25 8.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.137 0.494 . . . . 7.59 110.247 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -98.87 75.85 2.11 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.295 0.569 . . . . 8.84 110.556 -177.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -82.57 -54.73 4.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.242 -0.89 . . . . 10.06 109.193 175.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 32.0 p-10 -121.93 178.02 5.06 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.466 -1.243 . . . . 12.32 109.258 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 97.9 mttt 56.7 44.53 23.5 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.625 0.726 . . . . 14.02 110.289 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -81.27 6.26 14.69 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.033 -0.985 . . . . 15.92 111.367 -175.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 73.01 -31.28 0.22 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.74 0.816 . . . . 17.13 112.478 175.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.25 -58.49 7.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.621 0.248 . . . . 18.06 110.784 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.573 -0.727 . . . . 19.51 110.093 176.327 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' P' P ' 600' ' ' ' A' . . . . . 0.736 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.425 -0.963 0 C4'-C3'-C2' 100.702 -1.998 . 0.0 '__' . 2.3 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' P' P ' 601' ' ' ' U' . . . . . 0.804 " O2'" HG21 ' A' ' 65' ' ' THR . . . . . . . . 0 C3'--C2' 1.509 -1.414 1 C4'-C3'-C2' 97.216 -5.484 OUTLIER-DELTA 0.0 OUTLIER gamma 0.86 . . . . . . . . . . 4 4 . 1 . 007 nuclear build full ' P' P ' 602' ' ' ' C' . . . . . 0.533 ' OP1' ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 C4'-C3'-C2' 105.913 3.213 OUTLIER-DELTA 0.0 OUTLIER . 7.11 . . . . . . . . . . 3 3 . 1 . 007 nuclear build full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 C4'-C3'-C2' 105.471 2.771 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 112.31 -0.316 . . . . 9.19 112.31 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.92 116.85 33.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.99 0.424 . . . . 7.69 110.03 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 13.9 tpt -79.63 -63.92 1.3 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.189 -0.46 . . . . 7.18 109.913 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 51.22 79.91 0.09 Allowed 'General case' 0 C--O 1.233 0.222 0 O-C-N 123.826 0.704 . . . . 4.5 111.126 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -63.04 127.83 33.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.17 -0.468 . . . . 4.1 111.075 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -101.61 82.52 2.3 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.325 -0.62 . . . . 1.79 109.325 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.475 ' O ' HG23 ' A' ' 11' ' ' VAL . 39.1 t -63.31 119.23 9.25 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.648 -0.501 . . . . 1.33 109.648 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.839 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 63.6 mt-30 -55.87 -29.89 60.66 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.346 0.498 . . . . 1.88 112.346 -173.635 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -65.38 -50.17 66.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.084 0.469 . . . . 2.17 110.287 176.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.566 ' HE3' ' HB3' ' A' ' 13' ' ' ASP . 0.3 OUTLIER -70.25 -37.45 74.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.918 -0.583 . . . . 2.55 109.885 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.676 ' O ' HG12 ' A' ' 15' ' ' ILE . 69.5 t -57.14 -47.62 83.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.228 -0.286 . . . . 0.39 110.228 177.579 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.23 -42.86 70.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.206 0.527 . . . . 0.35 111.029 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.566 ' HB3' ' HE3' ' A' ' 10' ' ' LYS . 35.8 t70 -70.37 -39.73 74.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.687 -0.688 . . . . 0.86 110.537 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 18' ' ' ARG . 7.6 tp10 -61.46 -45.2 95.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.118 -0.947 . . . . 2.05 111.292 -177.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.676 HG12 ' O ' ' A' ' 11' ' ' VAL . 5.2 mm -59.98 -52.17 64.33 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-O 121.067 0.461 . . . . 0.33 109.925 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.624 ' HB3' HG21 ' A' ' 27' ' ' ILE . 19.4 p -64.95 -38.88 92.45 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.642 -0.708 . . . . 0.32 111.32 -175.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -59.23 -45.61 90.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.783 -0.644 . . . . 0.59 110.949 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 14' ' ' GLU . 75.0 mtt180 -79.04 -33.7 44.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.603 -0.272 . . . . 2.83 111.529 -177.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.941 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.2 mm? -79.29 -9.4 59.57 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.445 0.535 . . . . 0.99 112.445 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 58.57 34.65 24.03 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 108.079 -1.082 . . . . 1.6 108.079 -171.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.584 ' HG2' ' O4 ' ' P' ' 601' ' ' ' U' . 1.3 tm-20 -71.8 126.07 91.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 114.089 -1.414 . . . . 1.31 111.91 -165.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.46 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 73.6 Cg_endo -69.93 -46.65 1.08 Allowed 'Trans proline' 0 N--CA 1.476 0.463 0 C-N-CA 124.657 3.571 . . . . 0.41 114.345 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.708 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 33.0 pttt -109.85 66.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.382 0.611 . . . . 1.41 110.494 -169.012 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.551 ' HA ' HG22 ' A' ' 27' ' ' ILE . 83.6 mttt -59.32 -12.44 5.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.523 -1.217 . . . . 1.75 113.411 -167.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.13 -46.61 86.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.374 0.607 . . . . 2.14 109.662 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.61 HD11 ' HA ' ' A' ' 89' ' ' PHE . 6.6 tt -73.36 -41.57 63.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.289 -0.868 . . . . 1.33 110.812 -177.065 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.624 HG21 ' HB3' ' A' ' 16' ' ' SER . 6.4 tp -65.87 -30.04 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 121.004 0.43 . . . . 0.44 110.413 -177.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.703 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.18 -33.82 63.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.579 0.704 . . . . 0.21 110.333 173.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 33' ' ' ILE . 38.7 ttm180 -63.03 -39.15 93.89 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.296 -0.865 . . . . 1.48 111.763 -179.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.662 HG21 ' HE1' ' A' ' 70' ' ' PHE . 23.1 t -52.78 -43.16 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.128 -0.693 . . . . 1.1 109.128 177.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.703 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.0 t -53.18 -50.07 48.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.278 -1.328 . . . . 0.22 110.855 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -59.49 -43.82 93.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.22 -0.9 . . . . 3.75 111.429 -177.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.778 HG13 HG12 ' A' ' 88' ' ' ILE . 38.9 mm -75.55 -49.73 26.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.672 . . . . 0.8 112.5 -173.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 30' ' ' VAL . 36.4 pt -94.76 -29.07 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.604 0.594 . . . . 0.4 112.604 -172.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.33 162.17 10.81 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.556 -0.83 . . . . 0.26 112.673 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.839 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 20.4 p-10 -67.59 -55.99 11.21 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.515 0.326 . . . . 0.91 111.667 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.56 -33.85 69.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.869 -0.419 . . . . 3.19 109.869 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 5.9 mmmm -56.83 -38.3 72.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.855 -0.611 . . . . 2.45 110.914 176.23 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.451 ' O ' HD22 ' A' ' 43' ' ' LEU . . . -71.42 -38.85 71.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.29 110.869 177.502 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.805 ' HA ' HD23 ' A' ' 43' ' ' LEU . 22.3 mt -71.42 -33.26 49.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.45 -0.341 . . . . 1.13 111.308 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.46 -33.76 74.3 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.995 0.426 . . . . 2.1 110.179 173.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.839 HD22 ' HB3' ' A' ' 73' ' ' LEU . 79.0 mt -62.73 -36.7 83.84 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.914 -0.585 . . . . 0.29 110.47 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.805 HD23 ' HA ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -57.47 -32.73 67.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.575 0.226 . . . . 1.36 111.036 178.222 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 78.7 mmm -71.41 -39.52 71.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.993 0.425 . . . . 2.2 110.544 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.88 -24.46 62.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.129 -0.487 . . . . 1.83 111.886 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.601 HG22 HD11 ' A' ' 73' ' ' LEU . 43.1 p -54.47 -42.36 70.6 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.55 -0.46 . . . . 1.03 109.877 175.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.25 -39.99 76.72 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.107 -0.497 . . . . 0.88 111.032 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.86 -46.91 85.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.629 -0.714 . . . . 2.51 110.655 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 47.5 t -76.4 -32.08 21.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.339 -0.392 . . . . 0.76 111.263 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.883 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 22.2 mt-10 -67.35 -38.94 85.63 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.913 0.338 . . . . 1.96 111.913 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.07 -19.05 62.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.852 0.358 . . . . 2.25 111.224 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -106.31 -25.06 12.1 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.286 -0.415 . . . . 2.34 112.088 -176.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.86 50.21 9.23 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 116.007 -0.542 . . . . 1.33 113.6 174.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -109.7 118.43 5.13 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.123 -1.036 . . . . 0.89 114.606 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.729 ' HB3' ' HA ' ' A' ' 64' ' ' ARG . 46.6 tp -177.97 131.63 0.15 Allowed 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.471 0.545 . . . . 1.38 112.471 168.26 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -124.65 101.52 7.16 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.107 -1.071 . . . . 2.87 108.107 165.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.713 ' HA ' " O4'" ' P' ' 600' ' ' ' A' . 0.0 OUTLIER -68.85 -167.23 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 113.595 0.961 . . . . 0.68 113.595 -169.422 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.64 ' HE3' " H4'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -41.58 -48.01 3.94 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.534 -1.212 . . . . 0.91 111.52 177.902 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 18.8 t-20 -116.02 -37.01 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.41 . . . . 2.28 111.008 173.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.507 ' HA2' HG13 ' A' ' 57' ' ' ILE . . . 98.69 8.02 54.91 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.23 -0.986 . . . . 1.21 111.354 -171.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 5.3 p -54.66 -53.7 51.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.319 0.58 . . . . 2.18 110.867 -178.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.543 ' C ' HD11 ' A' ' 57' ' ' ILE . 5.0 ptp180 -112.12 53.58 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.6 -0.889 . . . . 2.89 108.6 171.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ARG . . . . . 0.458 ' HA ' ' CG1' ' A' ' 57' ' ' ILE . 14.9 ptp180 -50.36 132.42 24.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.786 -1.097 . . . . 3.59 112.211 -168.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.883 ' NH2' ' HA ' ' A' ' 50' ' ' GLU . 19.3 tpt85 68.26 44.82 1.32 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.992 0.901 . . . . 1.98 111.251 174.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.698 ' O ' HG23 ' A' ' 69' ' ' VAL . 4.7 t -74.14 144.01 81.25 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.891 -1.049 . . . . 0.44 110.176 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -46.27 -59.54 1.18 Allowed 'Trans proline' 0 N--CA 1.485 1.016 0 C-N-CA 124.365 3.377 . . . . 0.44 113.883 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.941 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -66.97 -35.3 89.25 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.267 -0.968 . . . . 0.25 111.115 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.648 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -58.33 -32.61 68.37 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.821 -0.689 . . . . 0.3 112.227 176.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.824 HG22 ' HD2' ' A' ' 64' ' ' ARG . 17.1 t -63.71 -35.04 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 CA-C-O 121.223 0.535 . . . . 0.74 110.561 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.662 ' HE1' HG21 ' A' ' 30' ' ' VAL . 14.5 t80 -65.29 -35.6 81.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.887 -0.597 . . . . 0.26 109.813 174.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.84 ' HB2' H5'' ' P' ' 600' ' ' ' A' . 0.3 OUTLIER -60.21 -34.8 74.15 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.961 -1.125 . . . . 0.32 107.961 177.228 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.685 ' HB2' HD13 ' A' ' 55' ' ' LEU . 54.1 t30 -63.08 -27.13 69.18 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.326 -0.852 . . . . 1.08 110.072 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.839 ' HB3' HD22 ' A' ' 42' ' ' LEU . 67.7 mt -61.05 -33.4 73.24 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.834 -0.621 . . . . 0.46 111.253 175.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.763 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.4 mp -63.98 -20.38 65.85 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.143 -0.48 . . . . 1.08 109.983 175.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.823 ' HZ1' HG21 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -85.11 -45.26 12.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.363 0.602 . . . . 1.93 109.837 172.046 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -81.58 9.11 8.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.133 -0.94 . . . . 2.12 111.379 -176.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.622 ' CG2' ' HB ' ' A' ' 80' ' ' ILE . 9.9 t -68.47 122.47 84.64 Favored Pre-proline 0 N--CA 1.446 -0.668 0 N-CA-C 108.899 -0.778 . . . . 0.94 108.899 176.111 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 21.1 Cg_exo -65.87 -39.33 20.12 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.839 2.36 . . . . 1.0 113.629 -164.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 19.5 m -113.23 5.66 17.07 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.298 0.851 . . . . 1.49 113.298 -175.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.622 ' HB ' ' CG2' ' A' ' 77' ' ' THR . 62.7 mt -113.24 138.94 41.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 121.862 -0.524 . . . . 1.21 111.283 -174.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.2 p -97.12 155.15 16.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.436 0.636 . . . . 1.79 111.656 -177.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 57.3 mm-40 -59.37 -27.03 65.59 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.076 1.139 . . . . 2.89 114.076 -171.234 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.85 -43.92 86.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.676 0.671 . . . . 2.06 110.916 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . 0.453 ' O ' HG13 ' A' ' 88' ' ' ILE . 75.6 mm-40 -67.36 -26.52 66.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.79 0.805 . . . . 2.31 109.157 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.823 HG21 ' HZ1' ' A' ' 75' ' ' LYS . 51.1 mm -75.9 -38.92 37.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.464 -1.244 . . . . 1.41 112.113 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 82' ' ' GLU . 8.0 mttm -57.7 -43.29 85.07 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 108.71 -0.848 . . . . 2.45 108.71 177.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -59.32 -32.89 70.49 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.885 -1.507 . . . . 1.7 109.862 -175.105 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.778 HG12 HG13 ' A' ' 33' ' ' ILE . 49.1 mt -71.94 -64.94 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.995 -1.002 . . . . 0.42 112.22 178.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.722 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -108.32 -19.05 13.6 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 114.77 1.396 . . . . 0.75 114.77 -167.368 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.722 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 89.3 t80 -76.88 -34.11 57.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.396 0.543 . . . . 1.13 110.454 -174.133 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.6 mt -69.19 -20.94 24.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.054 -0.521 . . . . 0.86 110.325 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 54.84 -92.59 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.358 -0.837 . . . . 2.67 111.305 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -142.94 36.0 1.39 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.608 0.718 . . . . 4.7 109.912 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -91.23 23.38 3.34 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.677 -0.692 . . . . 3.67 110.154 172.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 16.4 ttpp -81.37 65.84 6.67 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.624 -0.716 . . . . 7.97 110.596 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -90.47 -50.98 5.64 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.038 -0.528 . . . . 7.59 110.0 177.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -87.97 151.7 22.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.947 -0.569 . . . . 8.84 110.687 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -83.98 99.41 10.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.932 -0.576 . . . . 10.06 110.31 -177.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -88.51 -14.44 37.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.947 -0.57 . . . . 12.32 111.191 -174.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -68.53 124.48 23.7 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.373 -0.376 . . . . 14.02 110.322 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LYS . . . . . 0.494 ' H ' ' HD2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -78.22 98.13 5.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.044 -0.525 . . . . 15.92 111.552 -172.428 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -82.15 64.49 6.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.167 -0.47 . . . . 17.13 110.081 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -138.9 30.52 2.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.711 -0.677 . . . . 18.06 110.218 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 . . . . . 0 C--O 1.247 0.933 0 CA-C-N 115.299 -0.864 . . . . 19.51 110.128 -178.076 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' P' P ' 600' ' ' ' A' . . . . . 0.84 H5'' ' HB2' ' A' ' 71' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 99.892 -2.808 OUTLIER-DELTA 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 601' ' ' ' U' . . . . . 0.708 ' C6 ' ' HE2' ' A' ' 23' ' ' LYS . . . . . . . . 0 C3'--C2' 1.513 -1.129 1 C4'-C3'-C2' 97.83 -4.87 OUTLIER-EPSILON 0.0 OUTLIER gamma 0.86 . . . . . . . . . . 4 4 . 1 . 008 nuclear build full ' P' P ' 602' ' ' ' C' . . . . . 0.508 ' H41' ' HD3' ' A' ' 23' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 P-O3'-C3' 124.432 3.943 . 0.0 OUTLIER epsilon-1 7.11 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' P' P ' 603' ' ' ' G' . . . . . 0.704 " H3'" ' N3 ' ' P' ' 603' ' ' ' G' . . . . . . . . 0 O5'--C5' 1.426 -0.857 0 C4'-C3'-C2' 104.468 1.768 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 112.029 -0.428 . . . . 9.19 112.029 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.37 21.62 16.33 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.829 -0.218 . . . . 7.69 111.33 -175.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 65.8 mtt 59.34 43.33 16.81 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.144 -0.48 . . . . 7.18 111.325 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 64.27 36.5 9.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.578 -0.737 . . . . 4.5 112.072 175.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -96.18 12.67 29.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.467 0.651 . . . . 4.1 110.296 173.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -78.97 66.51 4.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.278 -0.874 . . . . 1.79 109.303 173.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -73.94 139.6 45.01 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.783 -0.821 . . . . 1.33 108.783 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.614 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 61.2 mt-30 -48.54 -45.77 37.9 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.974 0.731 . . . . 1.88 112.974 -169.173 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -63.67 -42.76 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 2.17 110.706 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -70.39 -37.13 74.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.04 0.448 . . . . 2.55 110.044 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.704 HG13 HD11 ' A' ' 15' ' ' ILE . 49.3 t -56.66 -51.91 60.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.634 -0.712 . . . . 0.39 110.865 177.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.18 -33.94 59.31 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.156 0.503 . . . . 0.35 111.206 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -70.38 -41.66 72.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.824 -0.625 . . . . 0.86 110.789 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -72.89 -42.63 63.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.372 -0.376 . . . . 2.05 111.597 -175.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.865 HD12 HD21 ' A' ' 43' ' ' LEU . 1.3 mm -58.68 -48.04 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 120.34 -0.544 . . . . 0.33 110.209 -177.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.666 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 21.7 p -64.57 -34.61 78.67 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.667 -0.697 . . . . 0.32 110.899 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -68.49 -44.06 75.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.196 -0.457 . . . . 0.59 110.481 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -69.46 -46.28 67.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.906 -0.588 . . . . 2.83 111.72 -176.629 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.842 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.2 mm? -85.1 1.43 47.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.087 0.402 . . . . 0.99 112.087 -175.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 55.68 33.17 20.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.241 0.543 . . . . 1.6 109.561 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.694 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.08 116.77 18.77 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 114.623 -1.171 . . . . 1.31 112.694 -168.031 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.472 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 52.5 Cg_endo -63.45 -40.26 32.15 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 124.011 3.141 . . . . 0.41 113.33 172.326 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.577 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 41.9 pttt -109.0 68.56 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.824 0.821 . . . . 1.41 109.463 -172.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.679 ' HA ' HG22 ' A' ' 27' ' ' ILE . 50.4 mttp -62.77 -12.56 24.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.68 -1.146 . . . . 1.75 113.542 -166.54 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -75.42 -33.85 60.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.117 0.484 . . . . 2.14 110.115 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.63 HD11 ' HA ' ' A' ' 89' ' ' PHE . 0.6 OUTLIER -73.57 -47.33 41.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 1.33 110.171 -178.548 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.694 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 11.0 tp -62.97 -29.43 47.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.216 -0.447 . . . . 0.44 110.895 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.658 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.94 -33.42 63.91 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.061 0.457 . . . . 0.21 110.673 174.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 88' ' ' ILE . 14.0 ttm180 -58.15 -40.15 80.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.032 -0.531 . . . . 1.48 110.874 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.539 HG21 ' HE1' ' A' ' 70' ' ' PHE . 23.3 t -53.06 -44.7 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.487 0.66 . . . . 1.1 109.535 177.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.658 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 82.0 t -52.95 -50.37 44.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 114.19 -1.368 . . . . 0.22 111.149 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -66.07 -41.92 90.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.298 -0.865 . . . . 3.75 111.14 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.493 HG13 HG12 ' A' ' 88' ' ' ILE . 50.1 mm -74.67 -50.27 26.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.897 -0.592 . . . . 0.8 112.541 -172.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.527 HG12 ' O ' ' A' ' 30' ' ' VAL . 33.1 pt -95.56 -29.49 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.106 -0.638 . . . . 0.4 111.902 -174.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.33 160.81 10.98 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.401 -0.904 . . . . 0.26 112.651 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.614 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 3.0 p-10 -67.84 -48.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.49 0.186 . . . . 0.91 111.409 -177.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.412 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 19.4 ptmt -71.73 -33.09 68.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.067 0.461 . . . . 3.19 109.876 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -64.31 -32.2 73.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.016 -0.538 . . . . 2.45 109.844 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.24 -42.52 75.53 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.869 -0.605 . . . . 0.29 109.991 173.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.772 ' HA ' ' HG ' ' A' ' 43' ' ' LEU . 44.8 mm -59.96 -37.68 73.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 120.921 0.391 . . . . 1.13 110.672 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 14.4 mm-40 -54.33 -46.45 72.9 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.236 -0.653 . . . . 2.1 109.236 173.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.944 HD22 ' HB3' ' A' ' 73' ' ' LEU . 72.2 mt -65.63 -43.18 90.29 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.268 -0.878 . . . . 0.29 111.279 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.865 HD21 HD12 ' A' ' 15' ' ' ILE . 4.8 mt -56.68 -38.74 72.65 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.024 0.44 . . . . 1.36 110.334 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 tpp -74.69 -39.78 61.77 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.215 -0.448 . . . . 2.2 109.926 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 40.6 mt-10 -70.01 -23.69 63.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.721 -0.672 . . . . 1.83 112.172 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.54 HG23 ' O ' ' A' ' 42' ' ' LEU . 71.6 p -51.1 -49.11 61.35 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.715 0.293 . . . . 1.03 110.25 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.62 82.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.724 -0.671 . . . . 0.88 111.481 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 36.6 mt-10 -66.94 -40.22 87.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.153 0.502 . . . . 2.51 110.389 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -76.85 -33.51 21.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.065 -0.516 . . . . 0.76 110.495 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 46' ' ' THR . 40.5 mt-10 -58.44 -51.47 69.71 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.344 -0.389 . . . . 1.96 111.27 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 5.3 pp0? -63.72 -22.76 67.07 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 123.371 0.419 . . . . 2.25 111.085 -176.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -89.47 -12.65 39.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.341 0.591 . . . . 2.34 110.394 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.45 28.93 64.75 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.673 -0.694 . . . . 1.33 112.488 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.422 ' O ' ' HB2' ' A' ' 55' ' ' LEU . . . -89.48 101.27 2.75 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.678 -0.772 . . . . 0.89 113.889 -174.018 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 1.11 HD11 HG23 ' A' ' 57' ' ' ILE . 2.7 tm? -176.62 124.57 0.17 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.102 0.477 . . . . 1.38 111.268 170.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -124.6 105.03 9.04 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.24 -1.022 . . . . 2.87 108.24 164.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.11 HG23 HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -77.5 -179.45 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 112.583 0.586 . . . . 0.68 112.583 -171.02 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.749 ' HE3' " O3'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -52.47 -43.93 65.28 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.778 -0.646 . . . . 0.91 111.481 -176.799 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -90.49 -37.54 13.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 2.28 110.989 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 83.75 -14.87 39.83 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.163 -0.541 . . . . 1.21 112.703 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -57.78 11.51 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.892 0.377 . . . . 2.18 111.253 -176.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -96.41 55.69 1.5 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.536 0.684 . . . . 2.89 109.605 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.5 ptt180 -53.89 146.36 14.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.127 -0.942 . . . . 3.59 111.795 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.643 ' H ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER 61.95 49.83 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.629 -1.169 . . . . 1.98 112.621 -177.815 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.864 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.8 t -75.51 142.01 73.78 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.256 -0.883 . . . . 0.44 109.457 169.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -47.31 -59.12 1.37 Allowed 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 123.831 3.021 . . . . 0.44 112.808 -175.533 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.842 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -62.65 -39.19 97.59 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.018 -0.833 . . . . 0.25 111.018 177.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.864 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.79 -31.97 61.44 Favored Glycine 0 N--CA 1.447 -0.579 0 CA-C-N 114.866 -0.667 . . . . 0.3 112.868 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 65' ' ' THR . 11.0 t -66.13 -38.33 81.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.124 0.487 . . . . 0.74 109.891 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.539 ' HE1' HG21 ' A' ' 30' ' ' VAL . 5.9 t80 -66.41 -38.69 88.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.162 -0.472 . . . . 0.26 109.932 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -57.0 -34.52 68.23 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.83 -0.804 . . . . 0.32 108.83 176.19 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.831 ' HB2' HD23 ' A' ' 55' ' ' LEU . 6.0 t30 -59.59 -38.94 82.56 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.559 -0.746 . . . . 1.08 110.154 176.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.944 ' HB3' HD22 ' A' ' 42' ' ' LEU . 70.9 mt -58.35 -35.06 71.37 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.55 -0.75 . . . . 0.46 112.084 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.594 ' HB3' HG23 ' A' ' 85' ' ' ILE . 14.7 mt -57.54 -47.02 83.14 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.326 -0.397 . . . . 1.08 110.961 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.645 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.1 OUTLIER -93.03 -7.75 44.86 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.142 -0.623 . . . . 1.93 111.808 -179.091 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -98.82 -18.0 18.17 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.221 -0.445 . . . . 2.12 111.013 -178.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.535 HG21 HD12 ' A' ' 80' ' ' ILE . 10.1 t -58.6 126.22 78.93 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.698 0.761 . . . . 0.94 110.973 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.2 Cg_exo -73.91 -25.75 13.93 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 123.31 2.674 . . . . 1.0 113.282 -171.219 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.0 t -101.35 -2.54 30.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.175 0.435 . . . . 1.49 112.175 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.535 HD12 HG21 ' A' ' 77' ' ' THR . 36.2 mt -119.29 136.87 55.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 121.931 -0.481 . . . . 1.21 110.911 -176.524 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -85.25 153.87 22.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.182 0.515 . . . . 1.79 110.578 -176.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.86 -30.35 71.45 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.306 -0.861 . . . . 2.89 112.942 -167.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.41 -36.88 79.74 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.94 -0.304 . . . . 2.06 111.437 -176.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -66.2 -36.08 82.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.61 0.719 . . . . 2.31 109.536 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 74' ' ' LEU . 45.8 mm -74.97 -36.62 39.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.878 -1.056 . . . . 1.41 111.629 -177.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.537 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 23.0 ttmm -51.55 -39.22 57.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 2.45 111.49 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -71.41 -33.1 69.14 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.053 -0.521 . . . . 1.7 111.498 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.501 HG21 HG22 ' A' ' 30' ' ' VAL . 57.7 mt -65.96 -67.7 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 112.569 0.581 . . . . 0.42 112.569 -170.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.826 ' H ' ' HD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -112.05 -27.56 8.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.466 0.543 . . . . 0.75 112.466 -170.596 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.537 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.7 t80 -67.35 -36.35 81.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.109 0.481 . . . . 1.13 111.233 -172.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.6 mt -65.16 -45.31 94.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 0.86 110.279 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 58.39 -92.24 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.457 -0.792 . . . . 2.67 111.798 175.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.2 p-10 -124.12 7.18 8.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.825 0.345 . . . . 4.7 110.802 -176.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -66.0 110.73 3.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.993 -0.548 . . . . 3.67 111.139 -176.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -125.13 157.38 36.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.999 -0.546 . . . . 7.97 109.834 177.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -127.31 -32.93 2.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.253 -0.431 . . . . 7.59 111.131 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -91.07 36.92 0.92 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.957 0.408 . . . . 8.84 110.84 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -97.14 134.69 40.14 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.65 -0.5 . . . . 10.06 109.65 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -156.61 150.41 24.82 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.163 -0.471 . . . . 12.32 110.858 -177.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -177.1 -41.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.605 -0.725 . . . . 14.02 109.701 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -160.38 98.24 1.26 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.022 -0.535 . . . . 15.92 109.783 173.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.94 30.29 19.53 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.617 -0.719 . . . . 17.13 111.214 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.27 27.77 12.29 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.863 -0.608 . . . . 18.06 110.827 -175.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 . . . . . 0 C--O 1.253 1.279 0 CA-C-O 118.582 -0.723 . . . . 19.51 109.829 -177.324 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' P' P ' 600' ' ' ' A' . . . . . 0.936 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.422 -1.099 0 C4'-C3'-C2' 100.03 -2.67 . 0.0 '__' . 2.3 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' P' P ' 601' ' ' ' U' . . . . . 0.749 " O3'" ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 C2'--C1' 1.538 0.974 1 C4'-C3'-C2' 97.033 -5.667 OUTLIER-EPSILON 0.0 OUTLIER alpha 0.86 . . . . . . . . . . 4 4 . 1 . 009 nuclear build full ' P' P ' 602' ' ' ' C' . . . . . 0.545 ' P ' ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 O5'--C5' 1.424 -0.98 1 P-O3'-C3' 125.668 4.974 . 0.0 OUTLIER epsilon-1 7.11 . . . . . . . . . . 3 3 . 1 . 009 nuclear build full ' P' P ' 603' ' ' ' G' . . . . . 0.45 " H3'" H5'' ' P' ' 602' ' ' ' C' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 O4'-C1'-N19 109.794 1.594 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.559 0 N-CA-C 111.863 -0.495 . . . . 9.19 111.863 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.05 105.54 1.38 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.946 0.403 . . . . 7.69 110.302 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 54.3 mtm -81.99 68.6 8.44 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.909 -0.587 . . . . 7.18 111.049 -175.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.4 -51.14 5.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.259 -0.428 . . . . 4.5 110.597 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 57.89 40.02 26.24 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 122.033 0.921 . . . . 4.1 109.843 -177.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 -94.68 67.63 3.3 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.409 -1.269 . . . . 1.79 110.41 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.454 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.8 m -64.94 130.92 45.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.596 -0.729 . . . . 1.33 110.289 177.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.776 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.7 mt-30 -51.43 -47.05 63.13 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.905 0.705 . . . . 1.88 112.905 -167.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.61 -46.7 87.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.407 0.146 . . . . 2.17 110.956 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -58.72 -41.63 86.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.035 0.445 . . . . 2.55 109.962 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.665 ' O ' HG12 ' A' ' 15' ' ' ILE . 78.3 t -60.03 -57.74 10.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.499 -0.773 . . . . 0.39 110.772 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.13 -38.23 70.54 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.291 0.567 . . . . 0.35 111.276 -176.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -39.29 89.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.434 -0.803 . . . . 0.86 110.665 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -76.71 -38.31 54.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.119 -0.491 . . . . 2.05 112.038 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.668 HG22 HD23 ' A' ' 19' ' ' LEU . 2.2 mm -61.28 -47.34 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 C-N-CA 120.376 -0.529 . . . . 0.33 110.036 -177.448 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' SER . . . . . 0.581 ' HB3' HG21 ' A' ' 27' ' ' ILE . 17.0 p -58.25 -38.51 77.04 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.944 -0.571 . . . . 0.32 110.791 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -68.69 -45.16 72.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 0.59 110.835 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -67.01 -43.38 83.02 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.238 0.458 . . . . 2.83 112.238 -175.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.668 HD23 HG22 ' A' ' 15' ' ' ILE . 3.6 mm? -79.41 -9.8 59.67 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.566 -0.454 . . . . 0.99 111.249 178.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 53.59 31.23 12.15 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.531 -0.914 . . . . 1.6 108.531 -170.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.615 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 19.6 tt0 -69.34 130.13 91.18 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 114.124 -1.398 . . . . 1.31 112.073 -169.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.542 ' HD2' ' O4 ' ' P' ' 601' ' ' ' U' . 43.4 Cg_endo -64.41 -54.84 0.69 Allowed 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 124.352 3.368 . . . . 0.41 113.238 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.522 ' HE3' ' H5 ' ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -85.61 67.89 10.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.918 0.866 . . . . 1.41 110.657 -176.848 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.475 ' O ' HG22 ' A' ' 27' ' ' ILE . 77.1 mttt -62.9 -19.69 64.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.518 -1.219 . . . . 1.75 112.143 -172.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.39 -41.62 85.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.195 0.521 . . . . 2.14 110.119 174.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.772 HD21 ' HA ' ' A' ' 89' ' ' PHE . 1.6 tm? -73.1 -42.93 62.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.431 -0.804 . . . . 1.33 110.811 -176.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ILE . . . . . 0.615 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 5.1 tp -61.32 -32.17 52.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.916 0.388 . . . . 0.44 110.375 -177.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ALA . . . . . 0.562 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.25 -35.15 61.44 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.235 -0.439 . . . . 0.21 110.881 174.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.2 ttm-85 -62.31 -41.12 98.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.34 -0.391 . . . . 1.48 111.21 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' VAL . . . . . 0.571 ' O ' HG12 ' A' ' 34' ' ' ILE . 28.8 t -53.83 -45.25 62.3 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.192 0 CA-C-O 121.307 0.575 . . . . 1.1 109.595 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.562 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.5 t -53.21 -51.69 37.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 114.503 -1.226 . . . . 0.22 110.748 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -59.67 -42.64 93.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 3.75 111.709 -177.108 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.445 HG13 HG12 ' A' ' 88' ' ' ILE . 45.1 mm -74.99 -53.03 17.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 112.882 0.697 . . . . 0.8 112.882 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ILE . . . . . 0.571 HG12 ' O ' ' A' ' 30' ' ' VAL . 29.8 pt -95.71 -7.63 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 112.192 0.441 . . . . 0.4 112.192 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.07 161.91 26.56 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.345 -0.931 . . . . 0.26 112.392 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . 0.776 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 13.8 p-10 -63.84 -42.31 97.63 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 122.377 0.271 . . . . 0.91 111.601 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 39.5 ttpt -67.33 -50.42 60.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.051 -0.26 . . . . 3.19 111.019 -175.396 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' LYS . . . . . 0.549 ' HB3' HD12 ' A' ' 34' ' ' ILE . 12.2 mmmt -61.47 -26.43 67.88 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.66 0.244 . . . . 2.45 111.66 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.483 ' O ' HD23 ' A' ' 43' ' ' LEU . . . -67.36 -47.66 69.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.01 -0.367 . . . . 0.29 110.01 176.07 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ILE . . . . . 0.653 ' HA ' HD21 ' A' ' 43' ' ' LEU . 49.4 mm -66.35 -38.15 81.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 120.986 0.422 . . . . 1.13 110.219 177.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 32.9 mm-40 -55.9 -38.89 70.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.814 -0.63 . . . . 2.1 110.051 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.687 HD22 ' HB3' ' A' ' 73' ' ' LEU . 22.0 mt -62.88 -43.42 98.85 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.161 -0.472 . . . . 0.29 112.093 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.653 HD21 ' HA ' ' A' ' 40' ' ' ILE . 0.1 OUTLIER -64.19 -28.58 69.84 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 119.579 -0.849 . . . . 1.36 111.094 178.895 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.2 mtp -73.9 -36.89 64.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.142 0.496 . . . . 2.2 110.002 170.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.3 mt-10 -65.77 -25.54 67.31 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.659 -0.7 . . . . 1.83 111.706 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.635 HG22 HD11 ' A' ' 73' ' ' LEU . 68.5 p -55.35 -40.0 70.72 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.868 0.366 . . . . 1.03 110.116 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.92 -32.86 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.88 110.859 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.473 ' HA ' ' HG3' ' A' ' 51' ' ' GLN . 29.1 mt-10 -71.41 -27.99 63.68 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.101 -0.5 . . . . 2.51 109.93 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 56.7 t -69.23 -43.25 81.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.118 0.485 . . . . 0.76 109.767 170.311 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 46' ' ' THR . 4.6 mm-40 -55.83 -42.99 76.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.42 -0.809 . . . . 1.96 110.44 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.473 ' HG3' ' HA ' ' A' ' 48' ' ' GLU . 5.3 pp0? -82.55 -19.02 39.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.106 -0.497 . . . . 2.25 111.686 -176.408 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -87.87 -26.7 22.63 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.271 0.471 . . . . 2.34 112.271 -171.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.95 -12.54 2.37 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 119.967 -1.111 . . . . 1.33 113.29 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.33 -133.18 10.95 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.093 -1.051 . . . . 0.89 114.81 171.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 1.072 HD11 HG23 ' A' ' 57' ' ' ILE . 0.6 OUTLIER -162.83 131.94 4.16 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.599 0.36 . . . . 1.38 110.895 -163.467 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PHE . . . . . 0.632 ' N ' HD22 ' A' ' 55' ' ' LEU . 34.6 t80 -116.74 110.55 18.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.269 -1.012 . . . . 2.87 108.269 168.716 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 1.072 HG23 HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -77.73 -178.41 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.375 0.88 . . . . 0.68 113.375 -170.444 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.776 ' HE3' " O3'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -50.92 -46.53 60.84 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 115.801 -0.636 . . . . 0.91 111.345 -177.206 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.563 ' HB3' " O5'" ' P' ' 602' ' ' ' C' . 0.6 OUTLIER -92.8 -36.74 12.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.081 -0.509 . . . . 2.28 110.212 176.423 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLY . . . . . 0.486 ' H ' HG13 ' A' ' 57' ' ' ILE . . . 84.22 -19.69 16.81 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 114.598 0.599 . . . . 1.21 114.598 169.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 8.4 t -66.7 -45.61 78.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 117.377 0.589 . . . . 2.18 110.412 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.549 ' O ' HD11 ' A' ' 57' ' ' ILE . 20.0 ttt180 -85.48 42.09 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.699 0.761 . . . . 2.89 109.687 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -46.95 132.04 11.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.477 -1.238 . . . . 3.59 113.076 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.732 ' HD3' ' N ' ' A' ' 55' ' ' LEU . 19.2 mmm180 68.42 57.97 0.44 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.754 -1.112 . . . . 1.98 112.238 175.142 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' THR . . . . . 0.667 HG23 ' HA3' ' A' ' 68' ' ' GLY . 5.3 t -82.73 144.69 49.02 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 114.779 -1.1 . . . . 0.44 108.19 169.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PRO . . . . . 0.561 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.45 -60.35 0.9 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 123.825 3.017 . . . . 0.44 113.746 -173.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.714 ' HA3' ' O4 ' ' P' ' 601' ' ' ' U' . . . -65.25 -37.22 93.74 Favored Glycine 0 C--O 1.224 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.25 111.163 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.667 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.37 -32.88 61.07 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.123 -0.539 . . . . 0.3 112.705 178.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 65' ' ' THR . 48.3 t -62.6 -40.69 89.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.226 0.536 . . . . 0.74 109.729 176.318 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . 0.543 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 12.5 t80 -65.24 -36.99 85.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.53 -0.759 . . . . 0.26 109.993 174.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.736 ' HB2' " O5'" ' P' ' 600' ' ' ' A' . 0.1 OUTLIER -57.54 -43.53 84.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.177 -1.046 . . . . 0.32 108.177 177.779 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ASN . . . . . 0.497 ' HB2' HD23 ' A' ' 55' ' ' LEU . 60.4 t30 -55.93 -26.42 47.72 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.73 0.643 . . . . 1.08 110.924 -178.016 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.687 ' HB3' HD22 ' A' ' 42' ' ' LEU . 77.0 mt -56.39 -41.59 76.54 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.024 -0.535 . . . . 0.46 111.297 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.877 ' HB3' HG23 ' A' ' 85' ' ' ILE . 6.5 mp -62.47 -19.02 63.12 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.014 0.435 . . . . 1.08 110.784 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LYS . . . . . 0.405 ' HG2' ' C5 ' ' P' ' 600' ' ' ' A' . 1.1 mppt? -91.62 -23.37 19.88 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.729 0.27 . . . . 1.93 111.729 178.607 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -114.64 -11.99 12.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.675 0.274 . . . . 2.12 111.446 -173.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.749 HG21 HD12 ' A' ' 80' ' ' ILE . 5.5 t -60.24 132.75 90.35 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 121.661 0.743 . . . . 0.94 111.281 -172.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 3.4 Cg_exo -74.3 -36.97 2.8 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 123.536 2.824 . . . . 1.0 114.676 -167.246 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 39.6 m -111.88 17.59 19.62 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.135 1.161 . . . . 1.49 114.135 -168.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.749 HD12 HG21 ' A' ' 77' ' ' THR . 44.0 mt -115.2 134.03 59.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 118.289 0.495 . . . . 1.21 110.523 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 41.2 m -75.9 143.98 41.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.651 0.739 . . . . 1.79 111.562 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.424 ' HA ' HD12 ' A' ' 85' ' ' ILE . 42.8 tt0 -52.58 -45.38 66.44 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.061 -1.427 . . . . 2.89 113.632 -168.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.82 -42.12 77.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.944 -0.302 . . . . 2.06 110.919 -177.826 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.32 -31.71 69.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.46 0.647 . . . . 2.31 110.001 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ILE . . . . . 0.877 HG23 ' HB3' ' A' ' 74' ' ' LEU . 97.3 mt -66.86 -45.85 86.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.776 -1.102 . . . . 1.41 111.404 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 14.0 ttmm -56.27 -39.52 72.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.889 -0.596 . . . . 2.45 111.083 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -66.65 -31.69 72.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.562 -0.745 . . . . 1.7 112.622 -173.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.445 HG12 HG13 ' A' ' 33' ' ' ILE . 43.3 mt -69.87 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.359 0.503 . . . . 0.42 112.359 -173.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.799 ' HE1' HO2' ' P' ' 600' ' ' ' A' . 9.9 p90 -95.59 -20.98 18.54 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.634 0.605 . . . . 0.75 112.634 -164.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 90.7 t80 -93.77 -10.38 34.37 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.298 -0.41 . . . . 1.13 111.865 -165.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt -91.88 -71.88 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.686 -0.405 . . . . 0.86 111.768 -176.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 45.37 -97.72 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.877 0.695 . . . . 2.67 112.877 -174.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -79.49 -37.01 37.73 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.875 0.324 . . . . 4.7 111.875 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -81.67 73.76 8.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.348 0.594 . . . . 3.67 110.342 -176.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -76.18 -65.45 0.92 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.365 -0.834 . . . . 7.97 110.828 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -168.64 85.96 0.18 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.828 -0.623 . . . . 7.59 109.939 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 40.2 m-85 -89.63 43.07 1.12 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 8.84 110.989 -178.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -81.39 58.97 3.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.236 0.541 . . . . 10.06 110.341 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASN . . . . . 0.482 ' HB2' ' NH1' ' A' ' 104' ' ' ARG . 18.6 p-10 -87.68 164.19 16.14 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.688 -0.687 . . . . 12.32 110.094 179.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . 0.42 ' HB2' ' HE3' ' A' ' 100' ' ' LYS . 21.1 ptmt -96.92 144.93 26.37 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.74 -0.467 . . . . 14.02 109.74 176.047 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -113.15 77.58 1.06 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.131 0.491 . . . . 15.92 110.591 -175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.98 -78.53 0.54 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.867 -0.606 . . . . 17.13 110.107 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -97.95 60.0 1.45 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.254 0.55 . . . . 18.06 110.147 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ARG . . . . . 0.482 ' NH1' ' HB2' ' A' ' 99' ' ' ASN . 41.3 ttm180 . . . . . 0 C--O 1.246 0.916 0 CA-C-N 115.485 -0.78 . . . . 19.51 110.061 -178.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 600' ' ' ' A' . . . . . 0.962 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.423 -1.086 0 C4'-C3'-C2' 101.179 -1.521 . 0.0 '__' . 2.3 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' P' P ' 601' ' ' ' U' . . . . . 0.776 " O3'" ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.509 -1.435 1 C4'-C3'-C2' 96.395 -6.305 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 010 nuclear build full ' P' P ' 602' ' ' ' C' . . . . . 0.563 " O5'" ' HB3' ' A' ' 59' ' ' ASN . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C4'-C3'-C2' 106.051 3.351 OUTLIER-DELTA 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 3 3 . 1 . 010 nuclear build full ' P' P ' 603' ' ' ' G' . . . . . 0.547 " H5'" ' N3 ' ' P' ' 603' ' ' ' G' . . . . . . . . 0 O5'--C5' 1.424 -1.015 0 O4'-C1'-C2' 107.403 0.717 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.776 ' HB3' HD12 ' A' ' 40' ' ' ILE . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.143 0 N-CA-C 112.571 0.582 . . . . 1.79 112.571 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.467 ' O ' HG23 ' A' ' 11' ' ' VAL . 28.5 t -74.93 121.8 22.46 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.141 -1.059 . . . . 1.33 108.141 170.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 36' ' ' ASN . 0.2 OUTLIER -56.64 -29.91 62.74 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.417 0.525 . . . . 1.88 112.417 -169.533 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.68 -47.96 70.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.907 0.384 . . . . 2.17 110.143 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -63.31 -40.49 97.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.887 -0.597 . . . . 2.55 110.25 175.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.657 ' O ' HG12 ' A' ' 15' ' ' ILE . 93.1 t -57.44 -54.56 29.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 0.39 110.606 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -40.09 75.86 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.954 0.407 . . . . 0.35 111.576 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.71 -32.83 73.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.944 -0.571 . . . . 0.86 110.519 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -71.8 -48.15 48.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.739 -0.664 . . . . 2.05 111.013 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 11' ' ' VAL . 1.2 mm -58.38 -50.89 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-O 121.277 0.561 . . . . 0.33 110.012 -178.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.557 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 12.7 p -59.08 -37.23 76.59 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.425 -0.807 . . . . 0.32 111.576 -175.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.71 -44.95 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.442 -0.344 . . . . 0.59 110.897 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.7 mtp85 -72.42 -29.47 63.74 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.507 0.558 . . . . 2.83 112.507 -173.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.633 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 3.8 mm? -93.97 0.04 55.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.758 0.313 . . . . 0.99 111.292 178.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 50.47 44.82 26.92 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 115.285 -0.871 . . . . 1.6 109.14 -173.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.842 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -61.26 120.15 52.37 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 114.523 -1.217 . . . . 1.31 112.427 -170.514 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 55.4 Cg_endo -64.46 -39.63 27.8 Favored 'Trans proline' 0 CA--C 1.529 0.273 0 C-N-CA 124.28 3.32 . . . . 0.41 113.084 174.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 35.2 pttt -120.45 63.8 0.84 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.195 0.522 . . . . 1.41 109.948 -172.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -56.25 -17.6 8.02 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.315 1.228 . . . . 1.75 114.315 -164.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.16 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 2.14 110.029 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.856 HD11 ' HB3' ' A' ' 89' ' ' PHE . 2.2 tm? -73.16 -51.57 17.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.573 -0.739 . . . . 1.33 110.387 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.842 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 7.3 tp -62.36 -32.29 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 116.231 -0.44 . . . . 0.44 111.03 -177.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.739 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -72.9 -33.0 65.74 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.56 0.695 . . . . 0.21 110.078 174.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.485 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 33.3 ttm180 -63.35 -40.92 98.61 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.23 -0.896 . . . . 1.48 111.908 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.67 ' HA ' HD13 ' A' ' 88' ' ' ILE . 33.0 t -53.19 -45.07 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 N-CA-C 108.781 -0.822 . . . . 1.1 108.781 177.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.739 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -53.02 -55.75 10.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.009 -1.45 . . . . 0.22 111.478 174.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -59.53 -40.14 86.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.608 -0.724 . . . . 3.75 111.304 -177.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.65 HG13 HG12 ' A' ' 88' ' ' ILE . 47.0 mm -75.3 -53.11 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.802 0.668 . . . . 0.8 112.802 -176.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.641 HG12 ' O ' ' A' ' 30' ' ' VAL . 28.3 pt -88.06 -29.28 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 C-N-CA 120.061 -0.656 . . . . 0.4 112.248 -171.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.54 156.2 8.54 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.33 -0.938 . . . . 0.26 112.644 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 8' ' ' GLN . 14.1 p-10 -62.25 -52.02 65.39 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.402 0.281 . . . . 0.91 111.568 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 84.8 tttt -71.74 -36.69 70.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 3.19 110.25 -179.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.424 ' HB2' HG13 ' A' ' 34' ' ' ILE . 11.1 mmmm -59.18 -29.76 67.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.701 -0.681 . . . . 2.45 111.269 -178.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.89 68.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.828 0.347 . . . . 0.29 110.676 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.776 HD12 ' HB3' ' A' ' 6' ' ' ASP . 37.1 mt -72.21 -34.19 48.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 120.911 0.386 . . . . 1.13 110.578 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 16.4 mm-40 -55.29 -39.62 70.08 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.219 -0.66 . . . . 2.1 109.219 172.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.814 HD22 ' HB3' ' A' ' 73' ' ' LEU . 66.8 mt -67.4 -35.51 79.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.346 -0.843 . . . . 0.29 111.101 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.627 HD21 HD13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -60.4 -37.23 80.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.906 0.384 . . . . 1.36 111.07 178.307 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.452 ' HE2' ' HA ' ' A' ' 41' ' ' GLU . 39.5 mtm -72.53 -36.49 68.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.265 0.555 . . . . 2.2 109.632 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -71.07 -28.36 64.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.538 -0.755 . . . . 1.83 111.317 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.86 HG23 HD11 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -61.0 -35.95 78.19 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 110.235 -0.283 . . . . 1.03 110.235 178.064 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -65.52 -35.07 79.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.048 0.452 . . . . 0.88 110.714 175.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.57 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 30.2 tt0 -68.31 -39.9 81.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.174 0.511 . . . . 2.51 109.657 178.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.4 t -69.11 -33.54 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.76 110.035 173.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.728 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 2.6 mm-40 -59.96 -44.06 94.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 1.96 111.233 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.57 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 17.7 pt20 -72.82 -19.73 61.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 2.25 111.245 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -100.09 -25.28 14.35 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.04 0.448 . . . . 2.34 111.766 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.21 41.67 25.81 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.963 -0.562 . . . . 1.33 113.228 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.87 128.99 9.41 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.55 -0.833 . . . . 0.89 113.922 -175.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 1.114 HD23 ' HB2' ' A' ' 72' ' ' ASN . 2.2 tm? -177.43 125.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.947 0.403 . . . . 1.38 110.43 170.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.53 ' N ' HD22 ' A' ' 55' ' ' LEU . 94.1 m-85 -124.26 108.69 12.51 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.498 -0.927 . . . . 2.87 108.498 165.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.847 HG23 HD11 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -82.84 -176.57 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.193 -0.458 . . . . 0.68 111.438 -178.277 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.81 -36.32 58.25 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.999 0.741 . . . . 0.91 112.999 -173.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.595 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 0.1 OUTLIER -88.71 -35.52 16.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.606 0.595 . . . . 2.28 112.606 -179.069 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.87 -19.86 10.89 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 121.64 -0.314 . . . . 1.21 112.492 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.595 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 57.8 m -71.13 -58.41 3.58 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.971 0.415 . . . . 2.18 110.145 177.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.417 ' CB ' HD11 ' A' ' 57' ' ' ILE . 99.8 mtt180 -67.96 138.1 55.67 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.655 -1.239 . . . . 2.89 107.655 167.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -142.63 126.01 16.65 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.421 -0.585 . . . . 3.59 109.421 -172.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.79 ' HD2' HG22 ' A' ' 69' ' ' VAL . 0.0 OUTLIER 62.51 56.07 2.12 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.476 -0.784 . . . . 1.98 112.194 -175.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.891 HG23 ' HA3' ' A' ' 68' ' ' GLY . 2.2 t -78.82 139.21 57.74 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 108.114 -1.069 . . . . 0.44 108.114 167.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.529 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.32 -59.76 1.1 Allowed 'Trans proline' 0 N--CA 1.48 0.685 0 C-N-CA 123.459 2.773 . . . . 0.44 112.978 -173.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.7 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -66.35 -38.86 94.0 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.407 -0.902 . . . . 0.25 111.245 177.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.891 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.68 -34.97 65.41 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.333 -0.433 . . . . 0.3 112.909 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.79 HG22 ' HD2' ' A' ' 64' ' ' ARG . 98.8 t -59.04 -42.78 87.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.106 0.479 . . . . 0.74 110.133 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.555 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 10.5 t80 -65.59 -37.01 85.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.825 -0.625 . . . . 0.26 109.975 174.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.7 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.39 -34.58 70.88 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.761 -0.829 . . . . 0.32 108.761 177.744 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 1.114 ' HB2' HD23 ' A' ' 55' ' ' LEU . 65.4 t30 -60.04 -30.61 69.3 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.656 -0.702 . . . . 1.08 110.186 177.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.86 HD11 HG23 ' A' ' 46' ' ' THR . 84.9 mt -58.62 -34.26 70.95 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.619 -0.719 . . . . 0.46 112.111 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.813 ' HB3' HG23 ' A' ' 85' ' ' ILE . 7.3 mp -65.73 -20.34 66.24 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.109 0.48 . . . . 1.08 110.795 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.624 ' HE2' ' HA ' ' A' ' 72' ' ' ASN . 8.9 mtmm -92.79 -34.35 13.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.281 0.562 . . . . 1.93 110.254 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -87.46 -13.11 44.1 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.154 -0.93 . . . . 2.12 110.877 -173.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.512 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 14.7 t -62.76 130.26 93.64 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.737 0.78 . . . . 0.94 110.751 -177.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 2.8 Cg_exo -74.86 -39.95 1.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.439 2.76 . . . . 1.0 113.725 -171.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.2 m -112.94 16.15 19.5 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.105 1.15 . . . . 1.49 114.105 -167.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.419 HD13 HG21 ' A' ' 34' ' ' ILE . 55.8 mt -112.6 137.69 44.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 118.683 0.674 . . . . 1.21 111.437 -177.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.4 m -74.04 141.44 45.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.523 -0.762 . . . . 1.79 111.042 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.15 -27.56 69.04 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.182 -0.917 . . . . 2.89 112.869 -174.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.84 -46.72 84.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 2.06 110.137 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.564 ' O ' HG13 ' A' ' 88' ' ' ILE . 77.9 mm-40 -60.68 -38.86 86.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 2.31 109.869 177.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.813 HG23 ' HB3' ' A' ' 74' ' ' LEU . 33.4 mm -60.03 -50.65 79.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.377 -0.829 . . . . 1.41 110.608 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.546 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 18.8 ttpt -60.06 -43.46 95.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.608 -0.724 . . . . 2.45 110.284 176.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -63.72 -34.31 77.58 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.411 -0.813 . . . . 1.7 111.715 -174.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.67 HD13 ' HA ' ' A' ' 30' ' ' VAL . 72.9 mt -70.29 -72.34 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.174 0.435 . . . . 0.42 112.174 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.856 ' HB3' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -106.48 -16.38 14.55 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.361 0.874 . . . . 0.75 113.361 -168.589 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.662 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 86.9 t80 -77.47 -24.75 50.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.355 0.598 . . . . 1.13 110.212 -173.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt . . . . . 0 C--N 1.321 -0.631 0 CA-C-N 115.561 -0.745 . . . . 0.86 109.721 174.051 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.739 ' HB2' HD22 ' A' ' 36' ' ' ASN . 3.6 m-20 . . . . . 0 N--CA 1.454 -0.246 0 N-CA-C 109.693 -0.484 . . . . 1.79 109.693 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.437 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.2 m -58.33 124.34 19.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.66 -0.496 . . . . 1.33 109.66 176.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.474 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.9 mt-30 -57.21 -32.28 66.33 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.883 -0.599 . . . . 1.88 112.155 -169.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.92 -42.1 73.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.065 0.46 . . . . 2.17 110.291 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -71.03 -38.87 72.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.815 -0.63 . . . . 2.55 110.277 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.655 ' O ' HG12 ' A' ' 15' ' ' ILE . 69.3 t -58.12 -51.53 69.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.39 110.981 178.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.95 -37.52 63.99 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.088 0.47 . . . . 0.35 111.155 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -68.69 -41.23 79.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.643 -0.708 . . . . 0.86 110.191 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 41.1 mm-40 -64.77 -47.41 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.572 -0.74 . . . . 2.05 111.907 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.756 HG23 HD21 ' A' ' 43' ' ' LEU . 3.4 mm -60.38 -49.87 82.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.887 0.375 . . . . 0.33 110.326 -175.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.6 ' HB3' HG21 ' A' ' 27' ' ' ILE . 23.1 p -61.16 -32.66 72.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.95 -0.568 . . . . 0.32 111.314 -176.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -70.54 -44.98 66.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.162 -0.472 . . . . 0.59 110.649 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 77.8 mtt180 -75.25 -31.36 60.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 2.83 111.693 -173.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.633 HD11 ' HB2' ' A' ' 70' ' ' PHE . 3.9 mm? -82.54 -15.56 51.86 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.623 -0.431 . . . . 0.99 111.173 174.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 55.18 29.91 13.54 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 108.395 -0.965 . . . . 1.6 108.395 -170.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.492 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 24.7 tt0 -71.73 132.96 84.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 113.904 -1.498 . . . . 1.31 112.271 -168.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.429 ' HD2' ' HG3' ' A' ' 21' ' ' GLU . 38.8 Cg_endo -63.47 -49.01 4.94 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 124.737 3.625 . . . . 0.41 113.625 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.604 ' HD2' ' HB3' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -89.99 69.81 7.41 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.006 0.908 . . . . 1.41 110.708 -175.314 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.505 ' O ' HG22 ' A' ' 27' ' ' ILE . 77.7 mttt -66.88 -23.82 66.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.175 . . . . 1.75 112.513 -170.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.37 -37.28 86.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.364 0.602 . . . . 2.14 110.021 175.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.604 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 1.4 tm? -72.93 -40.98 64.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.348 -0.842 . . . . 1.33 110.479 -178.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.6 HG21 ' HB3' ' A' ' 16' ' ' SER . 3.8 tp -63.09 -31.15 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 121.079 0.466 . . . . 0.44 109.919 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.656 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.48 -34.09 65.17 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.913 -0.585 . . . . 0.21 110.562 174.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -62.3 -41.38 98.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.211 -0.45 . . . . 1.48 110.923 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 34' ' ' ILE . 19.9 t -54.02 -44.59 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 N-CA-C 109.001 -0.74 . . . . 1.1 109.001 177.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.656 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 91.8 t -53.2 -49.04 53.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 114.34 -1.3 . . . . 0.22 111.038 175.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 32' ' ' ARG . 49.4 mtt180 -60.55 -47.48 86.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.586 -0.734 . . . . 3.75 110.862 -178.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 41.7 mm -73.94 -52.24 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.701 -0.681 . . . . 0.8 112.329 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.609 HG12 ' O ' ' A' ' 30' ' ' VAL . 21.4 pt -84.94 -28.86 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.628 -0.429 . . . . 0.4 111.944 -172.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.21 155.98 9.94 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.4 -0.905 . . . . 0.26 112.263 -179.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.739 HD22 ' HB2' ' A' ' 6' ' ' ASP . 5.3 p-10 -59.51 -49.42 77.84 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.778 0.288 . . . . 0.91 111.778 -175.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -71.62 -33.67 69.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.811 0.339 . . . . 3.19 111.05 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.473 ' HB2' HG13 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -64.26 -31.68 72.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.038 -0.528 . . . . 2.45 110.832 -178.222 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.487 ' O ' ' HG ' ' A' ' 43' ' ' LEU . . . -64.15 -44.73 91.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.28 -0.418 . . . . 0.29 110.454 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.05 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.124 -0.489 . . . . 1.13 110.317 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 51.4 mt-10 -58.41 -42.95 88.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.127 -0.488 . . . . 2.1 110.822 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.839 ' HB3' HD13 ' A' ' 73' ' ' LEU . 53.1 mt -63.27 -37.87 88.95 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.512 -0.313 . . . . 0.29 110.847 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.756 HD21 HG23 ' A' ' 15' ' ' ILE . 85.6 mt -60.99 -30.78 70.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.073 0.463 . . . . 1.36 111.123 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.2 tmm? -73.99 -39.17 63.85 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.352 -0.611 . . . . 2.2 109.352 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 31.0 mt-10 -70.45 -25.49 63.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.658 -0.701 . . . . 1.83 112.464 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.655 HG22 HD11 ' A' ' 73' ' ' LEU . 71.2 p -52.04 -41.5 62.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.921 0.391 . . . . 1.03 110.717 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.56 -35.07 75.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.684 -0.689 . . . . 0.88 111.418 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -68.85 -33.93 74.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.984 0.421 . . . . 2.51 110.498 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 81.5 t -76.96 -35.81 24.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.967 0.413 . . . . 0.76 110.323 174.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.567 ' HA ' HH21 ' A' ' 64' ' ' ARG . 6.7 mm-40 -61.05 -43.56 98.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.042 -0.526 . . . . 1.96 111.361 177.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -69.81 -26.27 64.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.813 0.339 . . . . 2.25 110.782 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -83.17 -25.07 32.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 2.34 111.04 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.501 ' HA2' ' NH1' ' A' ' 64' ' ' ARG . . . 72.95 44.4 37.09 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.521 -0.763 . . . . 1.33 111.804 -178.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.43 126.01 7.09 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.248 -0.977 . . . . 0.89 114.865 -170.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.75 HD13 ' HB2' ' A' ' 72' ' ' ASN . 38.6 tp -176.87 127.72 0.17 Allowed 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.23 0.538 . . . . 1.38 111.72 163.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -119.27 112.69 19.79 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 107.971 -1.122 . . . . 2.87 107.971 163.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.589 HG12 ' HA ' ' A' ' 63' ' ' ARG . 1.1 pt -86.96 -165.36 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.805 -0.634 . . . . 0.68 111.516 -175.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.422 ' H ' ' HB ' ' A' ' 57' ' ' ILE . 3.9 mtt -42.12 -46.33 4.28 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.876 0.735 . . . . 0.91 111.806 -173.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -120.82 -33.27 3.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.101 -0.499 . . . . 2.28 111.193 -174.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.456 ' O ' ' HB3' ' A' ' 63' ' ' ARG . . . 106.16 -12.07 44.41 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.285 -0.96 . . . . 1.21 115.257 172.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 65.8 p -65.28 -55.88 15.85 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 118.46 1.13 . . . . 2.18 111.17 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.576 ' C ' HD11 ' A' ' 57' ' ' ILE . 60.4 mtp180 -81.71 26.9 0.47 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.528 -0.76 . . . . 2.89 110.368 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.589 ' HA ' HG12 ' A' ' 57' ' ' ILE . 25.8 ptt180 -46.53 133.39 10.15 Favored 'General case' 0 C--O 1.233 0.21 0 O-C-N 123.916 0.76 . . . . 3.59 112.434 -169.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.892 ' HD2' HG22 ' A' ' 69' ' ' VAL . 4.8 tpt180 73.14 80.67 0.13 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.002 -0.999 . . . . 1.98 111.817 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.873 HG23 ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER -105.36 147.72 35.08 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.885 -1.052 . . . . 0.44 108.279 172.127 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.481 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.9 Cg_endo -45.76 -59.69 1.1 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 123.536 2.824 . . . . 0.44 112.998 -176.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.689 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -63.31 -40.74 99.31 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.085 -1.055 . . . . 0.25 110.85 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.873 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.46 -29.56 57.43 Favored Glycine 0 CA--C 1.52 0.379 0 CA-C-N 115.139 -0.53 . . . . 0.3 113.289 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.892 HG22 ' HD2' ' A' ' 64' ' ' ARG . 41.5 t -67.75 -33.59 62.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.118 0.485 . . . . 0.74 109.997 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.633 ' HB2' HD11 ' A' ' 19' ' ' LEU . 12.1 t80 -65.23 -35.74 81.98 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.305 -0.628 . . . . 0.26 109.305 171.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.689 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.22 -36.26 72.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.462 -0.94 . . . . 0.32 108.462 178.532 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.75 ' HB2' HD13 ' A' ' 55' ' ' LEU . 44.0 t-20 -56.58 -35.21 67.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.651 -0.704 . . . . 1.08 109.9 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.839 HD13 ' HB3' ' A' ' 42' ' ' LEU . 95.6 mt -58.13 -37.01 73.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.153 -0.931 . . . . 0.46 112.178 -176.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.876 ' HB3' HG23 ' A' ' 85' ' ' ILE . 6.4 mp -65.83 -28.87 69.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.162 0.506 . . . . 1.08 110.479 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.496 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -80.92 -42.5 21.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.121 0.486 . . . . 1.93 110.648 176.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -100.28 26.12 6.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.728 -0.669 . . . . 2.12 111.363 -173.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.501 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 5.4 t -80.95 124.73 81.19 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 121.447 0.642 . . . . 0.94 110.517 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.4 Cg_exo -75.78 -9.97 19.83 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.29 2.66 . . . . 1.0 113.01 -176.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.5 m -111.51 -20.71 12.1 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.208 0.818 . . . . 1.49 113.208 -170.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.423 ' HB ' HG21 ' A' ' 77' ' ' THR . 17.7 mt -111.4 139.87 33.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.774 0.321 . . . . 1.21 111.313 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.8 t -76.17 142.0 41.69 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.31 0.576 . . . . 1.79 110.044 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.402 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 1.8 mp0 -57.23 -37.59 72.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.691 -1.141 . . . . 2.89 113.116 -168.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.54 -37.28 85.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 2.06 110.764 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -68.37 -23.64 64.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.587 0.708 . . . . 2.31 110.073 -177.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.876 HG23 ' HB3' ' A' ' 74' ' ' LEU . 46.5 mm -70.73 -36.96 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.839 -1.073 . . . . 1.41 111.169 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.555 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 37.4 ttmt -56.83 -36.15 69.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.485 -0.78 . . . . 2.45 111.896 -177.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.52 -33.29 69.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 1.7 111.629 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.7 mt -70.95 -72.21 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 113.167 0.803 . . . . 0.42 113.167 -170.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.728 ' H ' ' HD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -104.3 -19.19 14.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.695 0.628 . . . . 0.75 112.695 -166.854 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.555 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 60.5 t80 -74.83 -23.86 58.52 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.311 0.577 . . . . 1.13 110.945 -173.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 47.1 mt . . . . . 0 C--N 1.323 -0.544 0 CA-C-N 115.605 -0.725 . . . . 0.86 111.022 -176.563 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.53 ' HB2' ' CG2' ' A' ' 11' ' ' VAL . 12.0 p-10 . . . . . 0 N--CA 1.451 -0.382 0 CA-C-O 121.713 0.768 . . . . 1.79 111.67 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.465 ' O ' HG23 ' A' ' 11' ' ' VAL . 17.5 m -79.86 127.87 32.75 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.443 -0.799 . . . . 1.33 109.363 175.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.714 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 3.4 pt20 -51.91 -43.65 63.49 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.731 1.011 . . . . 1.88 113.731 -167.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -71.36 -34.95 70.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.115 0.483 . . . . 2.17 110.268 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -65.67 -42.19 91.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 2.55 109.666 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.568 ' O ' HG12 ' A' ' 15' ' ' ILE . 60.2 t -62.15 -42.85 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.602 -0.726 . . . . 0.39 110.431 176.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.73 -41.7 77.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 0.35 111.36 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.27 -31.11 71.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.318 -0.401 . . . . 0.86 110.418 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.64 -50.54 64.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.463 -0.335 . . . . 2.05 110.779 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.861 HG23 HD21 ' A' ' 43' ' ' LEU . 2.0 mm -60.57 -49.48 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.768 0.318 . . . . 0.33 110.555 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.532 ' HB2' ' HD2' ' A' ' 24' ' ' LYS . 18.9 p -57.96 -43.04 86.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.864 -0.607 . . . . 0.32 111.454 -176.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.72 -41.52 98.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.666 -0.697 . . . . 0.59 111.141 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -77.42 -36.91 52.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 2.83 111.905 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.86 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.5 mm? -83.04 -5.61 59.17 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.973 0.36 . . . . 0.99 111.973 -178.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 55.82 39.97 30.68 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.762 -0.829 . . . . 1.6 108.762 -172.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.8 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.12 120.34 63.5 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.31 -1.313 . . . . 1.31 111.753 -171.065 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.429 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 71.6 Cg_endo -70.08 -34.96 12.55 Favored 'Trans proline' 0 N--CA 1.474 0.351 0 C-N-CA 123.976 3.117 . . . . 0.41 113.478 177.088 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.448 ' HE3' ' HG ' ' A' ' 26' ' ' LEU . 35.5 pttt -120.38 66.24 0.83 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.319 0.58 . . . . 1.41 109.499 -173.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.532 ' HD2' ' HB2' ' A' ' 16' ' ' SER . 40.1 mtmt -61.06 -12.41 11.78 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.035 1.124 . . . . 1.75 114.035 -163.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -69.23 -28.66 66.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.339 -0.544 . . . . 2.14 109.581 173.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.855 HD21 ' HA ' ' A' ' 89' ' ' PHE . 1.8 tm? -71.84 -52.05 19.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.46 -0.791 . . . . 1.33 109.926 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.8 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 10.1 tp -62.22 -34.58 64.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 0.44 110.525 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.71 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -70.88 -32.24 69.16 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.548 0.69 . . . . 0.21 110.477 174.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.43 ' O ' HG12 ' A' ' 33' ' ' ILE . 36.4 ttm180 -66.91 -41.6 86.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.548 -0.751 . . . . 1.48 111.587 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.729 HG21 ' HE1' ' A' ' 70' ' ' PHE . 16.3 t -53.4 -44.72 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 108.66 -0.867 . . . . 1.1 108.66 176.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.71 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.1 t -52.51 -53.42 20.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 113.63 -1.623 . . . . 0.22 111.201 175.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -66.24 -35.51 80.6 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.56 -0.745 . . . . 3.75 112.06 -174.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.636 HG13 HG12 ' A' ' 88' ' ' ILE . 50.5 mm -75.03 -51.82 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.294 0.479 . . . . 0.8 112.294 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.786 HG21 HD13 ' A' ' 80' ' ' ILE . 33.7 pt -90.18 -25.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.89 0.376 . . . . 0.4 111.854 -175.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.1 139.56 6.24 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.722 -0.751 . . . . 0.26 111.356 -175.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.714 ' HB3' ' HA ' ' A' ' 8' ' ' GLN . 0.9 OUTLIER -55.55 -37.95 68.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.834 0.349 . . . . 0.91 111.86 -179.195 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.47 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 34.0 ttmt -71.58 -33.87 69.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.145 0.498 . . . . 3.19 110.262 -178.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -69.86 -31.12 68.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.934 -0.576 . . . . 2.45 110.714 176.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.79 -38.66 91.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.13 0.49 . . . . 0.29 110.222 175.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.26 -41.65 93.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 115.912 -0.585 . . . . 1.13 110.441 176.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -55.73 -47.0 77.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.779 -0.646 . . . . 2.1 110.448 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.753 ' HB3' HD13 ' A' ' 73' ' ' LEU . 48.5 mt -60.58 -38.62 85.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.619 -0.719 . . . . 0.29 111.26 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.861 HD21 HG23 ' A' ' 15' ' ' ILE . 14.4 mt -60.05 -32.48 70.96 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.877 0.37 . . . . 1.36 111.498 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.8 mtp -74.59 -37.01 63.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.111 0.481 . . . . 2.2 109.881 175.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.418 ' O ' HG23 ' A' ' 49' ' ' VAL . 52.3 mt-10 -70.55 -27.45 64.15 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.444 -0.798 . . . . 1.83 111.623 179.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.534 HG23 HD11 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -62.87 -39.12 93.46 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.767 0.317 . . . . 1.03 110.833 -177.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.59 -44.15 89.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.53 . . . . 0.88 111.785 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.932 ' HA ' ' HG2' ' A' ' 51' ' ' GLN . 6.6 pt-20 -75.69 -30.27 59.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.671 -0.412 . . . . 2.51 111.422 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 45' ' ' GLU . 84.5 t -65.23 -35.62 75.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.496 0.665 . . . . 0.76 109.421 173.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.428 ' CG ' HG11 ' A' ' 69' ' ' VAL . 40.6 mt-10 -69.29 -47.02 65.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.553 -0.748 . . . . 1.96 111.121 175.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.932 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 17.0 pt20 -65.12 -27.04 68.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 2.25 110.728 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -94.27 -4.19 49.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.047 -0.524 . . . . 2.34 111.454 -177.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.23 50.08 41.76 Favored Glycine 0 C--N 1.331 0.28 0 CA-C-N 115.919 -0.582 . . . . 1.33 113.386 176.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -108.93 111.96 3.37 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.231 -0.985 . . . . 0.89 113.975 -177.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.763 HD21 HG23 ' A' ' 57' ' ' ILE . 34.6 tp -177.34 126.95 0.15 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.576 0.584 . . . . 1.38 112.576 167.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -125.65 93.54 3.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.592 -0.731 . . . . 2.87 109.081 164.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.763 HG23 HD21 ' A' ' 55' ' ' LEU . 3.8 pt -72.15 -170.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 112.451 0.537 . . . . 0.68 112.451 -176.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.417 ' H ' ' HB ' ' A' ' 57' ' ' ILE . 2.7 mtt -42.01 -47.63 4.46 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.88 0.738 . . . . 0.91 111.468 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.465 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 6.1 p30 -103.89 -35.81 8.02 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.797 -0.638 . . . . 2.28 111.746 -172.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 97.13 -19.52 54.47 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.069 -0.586 . . . . 1.21 113.701 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.465 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 66.1 m -72.61 -45.5 58.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.183 0.492 . . . . 2.18 111.251 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.746 ' HB3' HD11 ' A' ' 57' ' ' ILE . 7.4 ttm180 -80.47 49.37 1.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.91 0.862 . . . . 2.89 109.091 176.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.4 123.17 12.15 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.651 -1.159 . . . . 3.59 111.543 -173.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.742 ' HD2' HG22 ' A' ' 69' ' ' VAL . 1.2 mmm180 72.27 56.81 0.15 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 113.452 0.908 . . . . 1.98 113.452 173.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.714 HG23 ' HA3' ' A' ' 68' ' ' GLY . 3.9 t -77.74 140.65 63.51 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.657 -0.701 . . . . 0.44 109.159 169.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -48.18 -59.45 1.24 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 C-N-CA 124.047 3.165 . . . . 0.44 113.43 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.86 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -62.26 -39.86 98.26 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.868 -0.893 . . . . 0.25 110.868 177.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.714 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -58.94 -31.67 68.85 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.109 -0.546 . . . . 0.3 113.247 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.742 HG22 ' HD2' ' A' ' 64' ' ' ARG . 43.2 t -62.76 -36.39 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.181 0.515 . . . . 0.74 110.239 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.729 ' HE1' HG21 ' A' ' 30' ' ' VAL . 13.4 t80 -65.48 -36.37 83.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.955 -0.566 . . . . 0.26 109.634 173.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.619 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -59.4 -34.64 72.7 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.605 -0.887 . . . . 0.32 108.605 178.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.676 ' HB2' HD13 ' A' ' 55' ' ' LEU . 62.1 t30 -61.27 -30.41 70.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.266 -0.879 . . . . 1.08 110.489 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.753 HD13 ' HB3' ' A' ' 42' ' ' LEU . 71.1 mt -57.99 -36.09 72.14 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.296 -0.865 . . . . 0.46 111.885 -177.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.943 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.2 mp -60.83 -21.9 63.64 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.105 0.478 . . . . 1.08 110.859 -178.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.501 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -93.05 -38.45 11.62 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.989 -0.445 . . . . 1.93 111.576 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.63 ' OD1' ' HA ' ' A' ' 73' ' ' LEU . 2.9 p-10 -93.37 -8.14 42.73 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.914 -0.315 . . . . 2.12 111.648 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.55 HG21 ' HB ' ' A' ' 80' ' ' ILE . 7.9 t -56.22 127.65 70.98 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.436 0.636 . . . . 0.94 111.333 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.3 Cg_exo -76.07 -14.82 18.76 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.551 2.834 . . . . 1.0 113.055 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.6 m -112.31 -17.27 12.78 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.451 0.908 . . . . 1.49 113.451 -169.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.786 HD13 HG21 ' A' ' 34' ' ' ILE . 36.5 mt -103.84 139.98 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.03 0.443 . . . . 1.21 112.096 -169.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.425 ' O ' HG12 ' A' ' 85' ' ' ILE . 46.9 m -84.33 156.57 21.84 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.805 -0.634 . . . . 1.79 111.678 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.458 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 34.3 tt0 -65.92 -41.31 91.55 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.248 1.203 . . . . 2.89 114.248 -164.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.86 -47.03 85.13 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.55 -0.46 . . . . 2.06 111.63 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.571 ' O ' HG13 ' A' ' 88' ' ' ILE . 46.9 mt-30 -56.83 -33.56 66.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 2.31 110.528 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.943 HG23 ' HB3' ' A' ' 74' ' ' LEU . 36.3 mm -60.12 -50.74 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.796 -0.638 . . . . 1.41 110.652 177.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.8 ttpt -59.25 -39.1 81.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 2.45 110.753 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -65.84 -33.07 74.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.437 -0.347 . . . . 1.7 111.652 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.709 HG21 HG22 ' A' ' 30' ' ' VAL . 75.2 mt -70.44 -71.44 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.457 0.54 . . . . 0.42 112.457 -174.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.855 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -104.8 -10.78 17.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.32 0.859 . . . . 0.75 113.32 -165.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.536 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.9 t80 -89.46 -22.51 22.46 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.167 0.508 . . . . 1.13 110.947 -173.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.5 mt . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 116.092 -0.504 . . . . 0.86 110.852 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 . . . . . 0 N--CA 1.453 -0.321 0 CA-C-O 121.188 0.518 . . . . 1.79 109.944 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -56.03 131.84 48.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.463 -0.79 . . . . 1.33 109.427 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.574 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 96.7 mt-30 -58.44 -33.31 69.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.031 -0.531 . . . . 1.88 112.249 -173.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.15 -40.23 86.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.133 0.492 . . . . 2.17 110.42 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 62.5 tttm -70.24 -42.37 72.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.759 -0.655 . . . . 2.55 110.262 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.664 ' O ' HG12 ' A' ' 15' ' ' ILE . 91.1 t -59.26 -42.61 87.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.39 110.598 177.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.68 -41.42 73.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.038 0.447 . . . . 0.35 110.57 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -67.35 -42.12 84.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 0.86 110.426 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.568 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 71.6 mm-40 -56.86 -51.03 70.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.108 -0.496 . . . . 2.05 110.74 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.664 HG12 ' O ' ' A' ' 11' ' ' VAL . 4.6 mm -63.47 -51.8 66.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 120.709 -0.396 . . . . 0.33 110.318 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.679 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 31.4 p -64.03 -41.59 97.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.445 -0.343 . . . . 0.32 111.759 -172.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -62.54 -44.62 95.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.066 0.46 . . . . 0.59 110.646 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.2 mtt180 -78.73 -31.16 46.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.202 -0.454 . . . . 2.83 111.833 -175.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 1.07 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.3 mm? -77.56 -15.73 59.08 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 111.926 0.343 . . . . 0.99 111.926 177.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 57.15 41.22 27.48 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 107.65 -1.241 . . . . 1.6 107.65 -166.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.679 ' HB3' ' HA ' ' A' ' 16' ' ' SER . 7.2 tp10 -81.18 115.7 57.95 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 113.243 -1.799 . . . . 1.31 110.968 -170.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.444 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 42.2 Cg_endo -61.98 -47.88 9.66 Favored 'Trans proline' 0 N--CA 1.477 0.535 0 C-N-CA 124.416 3.411 . . . . 0.41 113.521 177.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.419 ' NZ ' HD11 ' A' ' 71' ' ' LEU . 45.1 pttt -92.59 72.52 5.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.058 0.932 . . . . 1.41 109.649 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.665 ' HA ' HG22 ' A' ' 27' ' ' ILE . 65.5 mttt -65.23 -17.66 64.67 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.428 -1.26 . . . . 1.75 111.441 -173.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.34 -39.06 59.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.418 -0.355 . . . . 2.14 110.524 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.444 ' O ' HD13 ' A' ' 26' ' ' LEU . 1.8 tm? -73.43 -43.61 60.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.003 0.43 . . . . 1.33 109.966 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.672 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 10.6 tp -64.08 -26.92 41.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.969 -0.56 . . . . 0.44 109.756 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.687 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.22 -33.31 65.27 Favored 'General case' 0 CA--C 1.523 -0.073 0 CA-C-N 116.267 -0.424 . . . . 0.21 110.934 172.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.637 ' HG2' HG23 ' A' ' 88' ' ' ILE . 6.3 ttm180 -59.35 -45.74 90.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.718 0.266 . . . . 1.48 111.718 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.66 ' O ' HG12 ' A' ' 34' ' ' ILE . 9.5 p -57.55 -36.71 54.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.594 -0.521 . . . . 1.1 109.594 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.687 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 76.8 t -54.87 -50.51 61.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.112 -0.949 . . . . 0.22 110.779 173.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -63.49 -43.19 97.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.398 -0.819 . . . . 3.75 111.41 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.843 HD12 HG12 ' A' ' 88' ' ' ILE . 17.2 mt -74.96 -51.89 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.02 0.748 . . . . 0.8 113.02 -172.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 30' ' ' VAL . 34.1 pt -88.34 -28.2 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 120.274 -0.57 . . . . 0.4 111.661 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 153.86 8.66 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.363 -0.922 . . . . 0.26 112.492 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.574 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 24.7 p-10 -61.44 -40.25 93.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.672 0.272 . . . . 0.91 111.112 -179.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 87.2 tttt -72.06 -41.68 67.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.364 -0.38 . . . . 3.19 110.657 -178.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.574 ' HB3' HD12 ' A' ' 34' ' ' ILE . 13.8 mmmt -64.67 -27.72 69.12 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.114 -0.234 . . . . 2.45 111.365 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.4 ' O ' ' HG ' ' A' ' 43' ' ' LEU . . . -67.34 -40.2 85.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.053 0.454 . . . . 0.29 109.904 174.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 36' ' ' ASN . 45.3 mm -70.08 -40.13 78.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.079 176.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 15.5 mm-40 -58.65 -43.25 89.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.841 -0.618 . . . . 2.1 110.395 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.75 HD22 ' HB3' ' A' ' 73' ' ' LEU . 34.8 mt -59.98 -33.76 72.39 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.254 -0.43 . . . . 0.29 110.846 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.564 HD21 HG23 ' A' ' 15' ' ' ILE . 63.1 mt -62.91 -32.42 73.7 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.879 -0.328 . . . . 1.36 110.553 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.7 mmm -76.97 -39.64 49.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.935 0.398 . . . . 2.2 110.072 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.8 mt-10 -60.5 -27.18 67.39 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.699 -0.682 . . . . 1.83 111.501 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.556 HG23 ' O ' ' A' ' 42' ' ' LEU . 72.4 p -56.86 -37.48 71.38 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-O 120.607 0.241 . . . . 1.03 110.806 177.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -60.67 -37.58 82.06 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.057 -0.52 . . . . 0.88 111.754 -173.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.57 -37.2 82.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.939 0.399 . . . . 2.51 110.03 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.757 HG12 HH12 ' A' ' 64' ' ' ARG . 61.4 t -76.28 -32.65 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.023 0.44 . . . . 0.76 110.194 176.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.983 ' HA ' HH22 ' A' ' 64' ' ' ARG . 33.3 mm-40 -59.64 -48.56 81.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 1.96 111.541 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -69.89 -21.52 63.31 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.984 0.365 . . . . 2.25 111.984 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -96.99 -25.84 15.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.964 0.411 . . . . 2.34 112.001 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.27 45.62 14.52 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 116.011 -0.54 . . . . 1.33 113.506 176.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -102.29 129.01 9.74 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.488 -0.863 . . . . 0.89 114.5 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.925 HD13 ' HB2' ' A' ' 72' ' ' ASN . 58.9 tp -176.58 127.77 0.19 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.229 0.538 . . . . 1.38 112.16 165.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -121.33 108.88 14.23 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.563 -1.273 . . . . 2.87 107.563 162.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.834 HG23 HD21 ' A' ' 55' ' ' LEU . 0.9 OUTLIER -80.89 -174.93 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.426 -0.352 . . . . 0.68 111.904 -174.102 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -33.46 64.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.68 0.622 . . . . 0.91 112.68 -173.156 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -89.65 -36.46 15.24 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.179 -0.608 . . . . 2.28 112.166 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.85 -15.34 32.36 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.734 -0.547 . . . . 1.21 111.734 -175.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.0 m -72.58 -59.85 2.52 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.32 0.581 . . . . 2.18 110.961 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -85.09 145.69 27.52 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 106.255 -1.757 . . . . 2.89 106.255 167.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -132.27 130.97 41.59 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 119.358 -0.937 . . . . 3.59 110.645 -177.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.983 HH22 ' HA ' ' A' ' 50' ' ' GLU . 9.2 tpt180 69.95 88.13 0.11 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.932 0.872 . . . . 1.98 112.359 172.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.764 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.3 t -110.37 147.49 36.46 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.83 -1.077 . . . . 0.44 109.072 172.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -45.25 -58.85 1.38 Allowed 'Trans proline' 0 N--CA 1.486 1.077 0 C-N-CA 123.939 3.093 . . . . 0.44 113.29 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 1.07 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -63.46 -42.29 99.04 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 110.545 -1.022 . . . . 0.25 110.545 176.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.764 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.56 -28.93 56.91 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.667 -0.767 . . . . 0.3 113.403 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.913 HG22 ' HD2' ' A' ' 64' ' ' ARG . 22.7 t -67.53 -36.67 77.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.199 0.523 . . . . 0.74 110.008 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.575 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 7.6 t80 -66.08 -37.31 85.46 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.792 -0.64 . . . . 0.26 109.438 171.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.22 -36.8 73.68 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 108.21 -1.033 . . . . 0.32 108.21 176.249 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.925 ' HB2' HD13 ' A' ' 55' ' ' LEU . 65.3 t30 -60.31 -30.91 69.8 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.133 -0.94 . . . . 1.08 110.302 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.75 ' HB3' HD22 ' A' ' 42' ' ' LEU . 50.5 mt -60.77 -39.53 89.15 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.831 -0.622 . . . . 0.46 112.008 -178.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.78 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.3 mp -57.68 -34.94 69.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.055 0.455 . . . . 1.08 110.807 -178.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.731 ' HG2' ' O ' ' A' ' 72' ' ' ASN . 0.3 OUTLIER -93.72 -6.02 47.13 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.209 -0.307 . . . . 1.93 110.828 -177.145 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -115.21 -27.87 7.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.516 -0.311 . . . . 2.12 111.759 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.529 HG23 ' HB ' ' A' ' 80' ' ' ILE . 13.8 t -58.0 117.68 21.29 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-O 122.011 0.91 . . . . 0.94 110.201 -177.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.1 Cg_exo -72.94 -15.71 26.16 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 123.511 2.808 . . . . 1.0 113.857 -161.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 40.0 t -105.96 5.5 30.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.672 0.273 . . . . 1.49 111.649 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.529 ' HB ' HG23 ' A' ' 77' ' ' THR . 34.0 mm -115.78 139.26 43.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.616 0.246 . . . . 1.21 110.792 -176.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.495 ' O ' HG12 ' A' ' 85' ' ' ILE . 39.2 t -78.68 140.96 38.3 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.204 0.526 . . . . 1.79 110.863 -177.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.29 -34.47 78.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 114.92 -1.036 . . . . 2.89 111.949 -175.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.78 -43.66 98.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.116 0.484 . . . . 2.06 110.551 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.15 -28.53 70.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.56 -0.746 . . . . 2.31 110.398 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.78 HG23 ' HB3' ' A' ' 74' ' ' LEU . 47.1 mm -69.88 -34.42 60.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.19 -0.914 . . . . 1.41 111.461 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.535 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.7 tmmm? -58.78 -34.85 71.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.093 0.473 . . . . 2.45 110.215 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.88 -31.31 67.93 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.922 -0.581 . . . . 1.7 111.087 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.843 HG12 HD12 ' A' ' 33' ' ' ILE . 34.8 mt -68.72 -67.82 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.625 0.602 . . . . 0.42 112.625 -173.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.539 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -112.29 -9.28 13.89 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.515 0.931 . . . . 0.75 113.515 -169.315 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.539 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 82.7 t80 -87.91 -24.87 23.5 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.076 0.465 . . . . 1.13 110.751 -174.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.439 HG22 ' O ' ' A' ' 91' ' ' ILE . 24.2 mt . . . . . 0 C--N 1.324 -0.531 0 CA-C-O 121.797 0.808 . . . . 0.86 109.864 177.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.423 ' HB3' HG13 ' A' ' 40' ' ' ILE . 5.1 p30 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 121.168 0.508 . . . . 1.79 111.14 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB2' ' HB3' ' A' ' 10' ' ' LYS . 0.3 OUTLIER -63.24 119.28 9.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.663 -0.495 . . . . 1.33 109.663 175.628 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.465 ' CD ' ' H ' ' A' ' 8' ' ' GLN . 21.6 mp0 -49.54 -47.97 48.67 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.098 0.407 . . . . 1.88 112.098 -167.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.83 -51.09 63.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.822 0.344 . . . . 2.17 110.915 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 7' ' ' SER . 34.3 tttm -55.28 -48.11 74.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.725 -0.67 . . . . 2.55 110.793 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.778 ' O ' HG12 ' A' ' 15' ' ' ILE . 72.2 t -60.33 -53.41 49.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.845 -0.616 . . . . 0.39 110.302 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB1' ' CB ' ' A' ' 28' ' ' ALA . . . -53.86 -39.29 65.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.261 0.553 . . . . 0.35 111.256 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.43 -45.46 76.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.494 -0.775 . . . . 0.86 110.625 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.57 ' HG2' ' HA ' ' A' ' 11' ' ' VAL . 15.4 pt-20 -76.39 -26.54 55.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.151 -0.477 . . . . 2.05 112.06 -176.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.778 HG12 ' O ' ' A' ' 11' ' ' VAL . 28.3 mm -56.34 -53.75 36.26 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 N-CA-C 108.946 -0.761 . . . . 0.33 108.946 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.673 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 22.0 p -66.52 -33.87 76.64 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.148 -0.933 . . . . 0.32 111.076 -178.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . 0.408 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 74.0 t80 -58.61 -41.7 86.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.054 -0.521 . . . . 0.59 110.451 175.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 52.7 mtt180 -77.74 -31.97 52.44 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.351 -0.386 . . . . 2.83 110.859 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.463 HD23 ' N ' ' A' ' 19' ' ' LEU . 0.7 OUTLIER -82.67 -20.48 36.11 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.068 -0.515 . . . . 0.99 111.629 -174.688 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 58.64 33.93 23.45 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.12 -1.067 . . . . 1.6 108.12 -164.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.673 ' HB2' ' HA ' ' A' ' 16' ' ' SER . 0.3 OUTLIER -61.58 130.68 92.27 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 113.375 -1.739 . . . . 1.31 112.396 -173.203 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 88.2 Cg_endo -72.57 -33.04 8.99 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 124.125 3.217 . . . . 0.41 113.47 172.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.5 ' HD2' HD13 ' A' ' 26' ' ' LEU . 42.6 pttt -113.35 67.81 0.67 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.084 0.945 . . . . 1.41 109.679 -174.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -66.16 -17.8 64.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.32 -1.309 . . . . 1.75 111.49 -172.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -76.19 -39.39 54.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.316 -0.402 . . . . 2.14 110.359 175.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.5 HD13 ' HD2' ' A' ' 23' ' ' LYS . 5.2 tt -73.58 -36.49 65.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.797 -0.446 . . . . 1.33 109.797 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.574 HG21 ' HB3' ' A' ' 16' ' ' SER . 1.9 tp -65.77 -27.51 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.626 -0.509 . . . . 0.44 109.626 176.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.707 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.3 -34.57 63.54 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.318 0.58 . . . . 0.21 110.363 171.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 16.7 ttm180 -61.37 -47.82 84.1 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.498 -0.774 . . . . 1.48 111.5 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.715 ' O ' HG12 ' A' ' 34' ' ' ILE . 12.7 p -58.49 -37.26 63.35 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.082 0 N-CA-C 109.73 -0.47 . . . . 1.1 109.73 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.707 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 41.1 t -52.57 -53.57 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.426 -0.807 . . . . 0.22 110.371 173.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.87 -42.41 99.75 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.347 -0.842 . . . . 3.75 111.052 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.596 HD12 HG12 ' A' ' 88' ' ' ILE . 32.7 mt -75.38 -52.15 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 113.312 0.856 . . . . 0.8 113.312 -174.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.715 HG12 ' O ' ' A' ' 30' ' ' VAL . 31.4 pt -82.3 -21.99 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.195 -0.602 . . . . 0.4 111.083 -176.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.33 146.45 9.24 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.584 -0.817 . . . . 0.26 111.438 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.433 ' O ' HG12 ' A' ' 40' ' ' ILE . 9.8 p-10 -63.42 -40.3 96.82 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 122.394 0.278 . . . . 0.91 111.519 -177.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.79 ' HD2' ' H ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -72.26 -34.01 67.92 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.802 -0.359 . . . . 3.19 110.991 178.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.671 ' HG3' HD12 ' A' ' 34' ' ' ILE . 14.6 tppt? -61.7 -42.0 98.35 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 110.145 -0.317 . . . . 2.45 110.145 176.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.463 ' O ' HD22 ' A' ' 43' ' ' LEU . . . -60.44 -42.39 96.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.051 -0.522 . . . . 0.29 110.49 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 36' ' ' ASN . 41.9 mm -61.37 -42.6 94.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.625 177.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 37' ' ' LYS . 46.9 mt-10 -61.22 -38.23 85.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.236 -0.438 . . . . 2.1 110.429 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.962 HD22 ' HB3' ' A' ' 73' ' ' LEU . 75.3 mt -65.41 -31.04 71.93 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.105 -0.498 . . . . 0.29 111.378 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.659 HD21 HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -62.35 -28.93 70.1 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.922 -0.486 . . . . 1.36 110.793 175.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.8 mtp -75.4 -35.21 61.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.322 0.582 . . . . 2.2 109.794 171.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.597 ' HB2' HD13 ' A' ' 73' ' ' LEU . 11.0 mm-40 -70.04 -26.8 64.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.536 -0.756 . . . . 1.83 111.461 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 43.3 p -57.01 -47.58 80.53 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.365 -0.606 . . . . 1.03 109.365 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -64.57 -35.81 82.18 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.837 -0.619 . . . . 0.88 110.914 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.668 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 21.9 tp10 -59.2 -49.3 78.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.925 -0.579 . . . . 2.51 109.566 176.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 79.7 t -70.58 -33.38 53.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.184 -0.462 . . . . 0.76 110.821 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.733 ' HA ' HH22 ' A' ' 64' ' ' ARG . 6.4 mm-40 -59.94 -34.48 73.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.6 -0.273 . . . . 1.96 111.612 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.668 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.1 pt20 -83.1 -24.03 32.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 2.25 110.644 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -88.8 -27.59 21.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 2.34 111.176 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.58 50.27 38.26 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 115.745 -0.661 . . . . 1.33 113.352 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.428 ' N ' ' HE ' ' A' ' 64' ' ' ARG . . . -132.28 121.24 2.94 Favored Glycine 0 C--O 1.223 -0.55 0 C-N-CA 119.706 -1.235 . . . . 0.89 114.225 -177.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 1.038 HD11 HG23 ' A' ' 57' ' ' ILE . 1.9 tm? -165.23 125.51 1.88 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.885 0.374 . . . . 1.38 110.165 171.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.525 ' N ' HD22 ' A' ' 55' ' ' LEU . 90.1 m-85 -119.16 113.73 21.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.77 -0.826 . . . . 2.87 108.77 171.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.038 HG23 HD11 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -87.37 -161.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.72 -0.673 . . . . 0.68 111.976 -175.493 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.439 ' H ' ' HB ' ' A' ' 57' ' ' ILE . 3.2 mtt -44.49 -48.71 10.1 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 123.759 0.662 . . . . 0.91 110.949 -175.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.545 HD22 ' H ' ' A' ' 61' ' ' SER . 1.1 p-10 -107.98 -28.32 9.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.738 -0.665 . . . . 2.28 111.338 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.88 -18.84 37.14 Favored Glycine 0 C--O 1.224 -0.505 0 C-N-CA 120.853 -0.689 . . . . 1.21 112.888 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.545 ' H ' HD22 ' A' ' 59' ' ' ASN . 40.5 m -56.76 -45.95 81.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.161 0.43 . . . . 2.18 112.161 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.441 ' O ' HD11 ' A' ' 57' ' ' ILE . 35.2 mtp180 -84.43 43.17 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.932 0.873 . . . . 2.89 109.326 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 63' ' ' ARG . 38.4 ttp180 -47.01 130.06 12.17 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 113.552 -1.658 . . . . 3.59 112.611 -170.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.733 HH22 ' HA ' ' A' ' 50' ' ' GLU . 0.1 OUTLIER 64.13 71.82 0.47 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.248 -0.887 . . . . 1.98 112.822 -178.274 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.833 HG23 ' HA3' ' A' ' 68' ' ' GLY . 3.1 t -90.49 140.76 26.88 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 107.973 -1.121 . . . . 0.44 107.973 166.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -47.7 -58.16 1.9 Allowed 'Trans proline' 0 N--CA 1.48 0.72 0 C-N-CA 123.581 2.854 . . . . 0.44 113.262 -171.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.658 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -69.29 -40.33 81.07 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.284 -0.96 . . . . 0.25 111.245 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.833 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -55.97 -28.2 52.75 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.515 -0.342 . . . . 0.3 113.075 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.73 HG22 ' HD2' ' A' ' 64' ' ' ARG . 70.4 t -63.09 -39.02 83.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.144 0.497 . . . . 0.74 110.69 176.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.443 ' CG ' HD11 ' A' ' 19' ' ' LEU . 6.9 t80 -66.32 -34.84 78.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.219 -0.446 . . . . 0.26 110.022 172.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.677 ' HG ' ' HA2' ' A' ' 68' ' ' GLY . 0.1 OUTLIER -55.3 -33.52 63.35 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 108.658 -0.867 . . . . 0.32 108.658 176.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.847 ' HB2' HD23 ' A' ' 55' ' ' LEU . 27.8 t-20 -56.06 -40.53 73.68 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.954 -0.566 . . . . 1.08 109.976 174.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.962 ' HB3' HD22 ' A' ' 42' ' ' LEU . 34.5 mt -67.91 -38.15 82.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.599 -0.728 . . . . 0.46 111.031 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.669 ' O ' HD12 ' A' ' 85' ' ' ILE . 5.0 tt -57.56 -38.95 75.63 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.817 -1.083 . . . . 1.08 109.734 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.686 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 12.6 pttt -93.89 -31.22 14.41 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.757 0.651 . . . . 1.93 112.757 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 72' ' ' ASN . 0.9 OUTLIER -97.28 19.97 12.26 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.838 0.31 . . . . 2.12 111.838 -174.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.681 HG21 HD12 ' A' ' 80' ' ' ILE . 4.1 t -68.44 120.2 73.48 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 109.118 -0.697 . . . . 0.94 109.118 172.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.516 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 9.3 Cg_exo -71.8 -9.47 24.87 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 123.077 2.518 . . . . 1.0 114.029 -166.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 77.3 p -111.23 1.25 17.09 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.118 0.414 . . . . 1.49 112.118 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.681 HD12 HG21 ' A' ' 77' ' ' THR . 47.3 mt -119.93 140.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 1.21 111.493 -175.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . 0.416 ' O ' HG12 ' A' ' 85' ' ' ILE . 23.3 t -82.46 154.75 24.97 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.566 0.698 . . . . 1.79 111.003 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.427 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 27.9 tt0 -60.71 -34.06 73.81 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.466 -1.243 . . . . 2.89 113.182 -167.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -63.0 -46.91 85.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.842 0.312 . . . . 2.06 111.842 -175.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.96 -32.55 72.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.209 0.528 . . . . 2.31 109.997 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.669 HD12 ' O ' ' A' ' 74' ' ' LEU . 30.8 mm -61.57 -44.93 99.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.169 -0.923 . . . . 1.41 110.963 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.58 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 36.4 ttpt -57.25 -40.69 78.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.505 -0.77 . . . . 2.45 111.516 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.92 -31.34 72.53 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.778 -0.646 . . . . 1.7 110.971 -174.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.596 HG12 HD12 ' A' ' 33' ' ' ILE . 44.8 mt -70.0 -71.37 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.601 0.593 . . . . 0.42 112.601 -175.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.509 ' CD1' HD13 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -110.57 -15.7 13.82 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.419 0.896 . . . . 0.75 113.419 -168.368 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 81.7 t80 -71.58 -27.32 63.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.378 0.608 . . . . 1.13 110.614 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 43.2 mt . . . . . 0 C--N 1.325 -0.498 0 CA-C-N 115.467 -0.788 . . . . 0.86 111.174 -178.808 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.404 ' HB3' HD12 ' A' ' 40' ' ' ILE . 6.5 p-10 . . . . . 0 N--CA 1.451 -0.377 0 CA-C-O 121.813 0.816 . . . . 1.79 110.69 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.48 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.2 m -72.28 130.37 40.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.317 -0.856 . . . . 1.33 110.27 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.569 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 52.5 mt-30 -47.91 -47.6 32.11 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.275 0.843 . . . . 1.88 113.275 -169.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -67.69 -39.15 84.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.751 0.31 . . . . 2.17 111.259 -176.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -70.11 -36.43 74.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.429 -0.35 . . . . 2.55 110.576 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.667 ' O ' HG12 ' A' ' 15' ' ' ILE . 85.9 t -58.14 -41.38 80.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.194 -0.457 . . . . 0.39 110.794 177.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -44.27 82.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.029 0.443 . . . . 0.35 111.157 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.06 -33.78 72.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.977 -0.556 . . . . 0.86 110.203 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -63.01 -43.9 97.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.645 -0.707 . . . . 2.05 110.647 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.704 HD13 HD11 ' A' ' 43' ' ' LEU . 5.0 mm -64.72 -51.0 72.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 N-CA-C 109.894 -0.41 . . . . 0.33 109.894 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.661 ' HB3' HG21 ' A' ' 27' ' ' ILE . 16.3 p -62.98 -40.55 98.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.32 111.267 -174.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -61.92 -45.16 94.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.59 111.178 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -74.2 -34.23 63.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.748 0.308 . . . . 2.83 111.785 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.477 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 29.1 mt -82.49 -13.84 56.01 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.441 -0.345 . . . . 0.99 111.915 -176.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 61.51 32.04 18.85 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 108.333 -0.988 . . . . 1.6 108.333 -170.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.732 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 7.6 tp10 -59.39 116.44 16.29 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 114.135 -1.393 . . . . 1.31 112.171 -172.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.519 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 59.9 Cg_endo -67.07 -46.58 2.99 Favored 'Trans proline' 0 N--CA 1.472 0.26 0 C-N-CA 124.066 3.177 . . . . 0.41 113.049 173.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.7 pttt -100.88 67.91 1.25 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.737 0.779 . . . . 1.41 109.894 -175.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.33 -17.95 56.25 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.128 -0.942 . . . . 1.75 112.255 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -57.54 -40.74 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 2.14 110.182 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.667 HD21 ' HA ' ' A' ' 89' ' ' PHE . 3.2 tm? -73.02 -45.52 57.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.396 -0.82 . . . . 1.33 110.334 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.732 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.0 tp -68.05 -28.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.997 -0.547 . . . . 0.44 111.083 -175.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.625 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.45 -34.67 60.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.41 . . . . 0.21 110.563 172.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.46 ' O ' HG12 ' A' ' 33' ' ' ILE . 12.6 ttm180 -63.08 -45.98 89.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 1.48 111.476 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 34' ' ' ILE . 12.5 p -55.64 -38.69 51.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.094 0.473 . . . . 1.1 109.878 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.625 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 65.3 t -54.87 -50.64 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.167 -0.924 . . . . 0.22 110.571 173.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.09 -40.81 95.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.141 -0.936 . . . . 3.75 110.959 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.625 HG13 HG12 ' A' ' 88' ' ' ILE . 39.1 mm -74.42 -48.54 35.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 115.993 -0.549 . . . . 0.8 112.236 -175.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 30' ' ' VAL . 32.0 pt -91.33 -29.1 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 120.379 -0.529 . . . . 0.4 112.288 -174.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.15 161.88 11.83 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.561 -0.828 . . . . 0.26 112.612 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.569 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 2.5 p-10 -65.07 -52.67 54.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.785 0.326 . . . . 0.91 111.72 -178.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -71.63 -32.9 68.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.924 0.392 . . . . 3.19 110.396 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -67.8 -29.91 69.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 2.45 111.056 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.69 -39.99 84.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 0.29 110.178 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.404 HD12 ' HB3' ' A' ' 6' ' ' ASP . 30.2 mt -69.34 -32.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.517 . . . . 1.13 110.911 176.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -58.72 -38.55 78.58 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.099 -0.334 . . . . 2.1 110.099 173.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.845 ' HB3' HD13 ' A' ' 73' ' ' LEU . 68.4 mt -71.41 -35.2 70.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.431 -0.35 . . . . 0.29 110.204 174.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.704 HD11 HD13 ' A' ' 15' ' ' ILE . 41.1 mt -63.99 -29.93 71.05 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.201 0.524 . . . . 1.36 111.545 176.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.8 tpp -75.97 -35.32 59.7 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.327 0.584 . . . . 2.2 109.684 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -69.87 -34.38 73.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.292 -0.867 . . . . 1.83 111.501 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 1.086 HG23 HD11 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -52.0 -36.61 50.42 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 112.097 0.406 . . . . 1.03 112.097 -176.451 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.51 85.4 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.628 0.233 . . . . 0.88 111.628 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.45 -30.6 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.402 0.62 . . . . 2.51 110.276 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.1 t -76.38 -44.86 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.363 -0.835 . . . . 0.76 110.546 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -56.14 -49.03 75.08 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.225 -0.898 . . . . 1.96 112.218 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.435 ' HG3' HD22 ' A' ' 52' ' ' ASN . 19.7 pt20 -60.75 -29.37 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 2.25 111.906 -173.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.435 HD22 ' HG3' ' A' ' 51' ' ' GLN . 0.9 OUTLIER -91.75 -25.22 19.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.976 0.417 . . . . 2.34 111.636 -177.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.08 -14.63 18.97 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.21 -0.519 . . . . 1.33 112.104 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 40.31 -81.91 0.0 OUTLIER Glycine 0 CA--C 1.528 0.899 0 N-CA-C 117.657 1.823 . . . . 0.89 117.657 167.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 1.059 HD11 HG23 ' A' ' 57' ' ' ILE . 2.8 tm? -74.85 132.01 41.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 115.252 1.575 . . . . 1.38 115.252 -156.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.57 ' N ' HD22 ' A' ' 55' ' ' LEU . 74.3 t80 -123.34 114.19 19.85 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.425 -1.261 . . . . 2.87 107.644 159.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.059 HG23 HD11 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -87.61 -172.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 114.125 1.158 . . . . 0.68 114.125 -168.611 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -55.39 -47.26 76.12 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 115.174 -0.921 . . . . 0.91 112.754 -172.056 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.742 HD22 ' N ' ' A' ' 60' ' ' GLY . 0.3 OUTLIER -91.62 -27.72 17.96 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 119.776 -0.77 . . . . 2.28 111.468 176.604 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.742 ' N ' HD22 ' A' ' 59' ' ' ASN . . . 82.61 -13.44 41.71 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.904 -0.665 . . . . 1.21 113.768 176.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.2 m -46.37 -58.48 3.69 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 122.89 0.476 . . . . 2.18 111.833 -177.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HG3' HD11 ' A' ' 57' ' ' ILE . 3.5 ptp180 -99.89 104.71 16.38 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.223 -0.658 . . . . 2.89 109.223 173.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -72.57 127.18 31.78 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.563 -0.455 . . . . 3.59 110.502 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.756 ' HA ' ' HB3' ' A' ' 55' ' ' LEU . 8.9 tpt85 71.22 98.74 0.07 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.968 -1.014 . . . . 1.98 112.814 175.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 1.003 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.1 t -109.31 147.85 36.83 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 114.268 -1.333 . . . . 0.44 108.862 168.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -51.51 -59.05 1.27 Allowed 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.124 2.55 . . . . 0.44 113.076 -175.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.586 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -66.22 -36.27 91.55 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.294 -0.955 . . . . 0.25 110.721 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 1.003 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.18 -32.06 59.74 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.911 -0.645 . . . . 0.3 112.927 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.675 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 0.4 OUTLIER -65.26 -32.57 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 117.459 0.63 . . . . 0.74 110.101 -178.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.57 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 18.6 t80 -67.42 -37.67 83.41 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.571 -0.529 . . . . 0.26 109.571 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.586 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -62.37 -34.78 77.36 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.381 -1.34 . . . . 0.32 107.381 176.549 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.733 ' HB2' HD23 ' A' ' 55' ' ' LEU . 65.7 t30 -59.67 -31.4 69.51 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 115.19 -0.914 . . . . 1.08 109.852 175.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 1.086 HD11 HG23 ' A' ' 46' ' ' THR . 87.8 mt -62.02 -33.1 73.73 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 115.683 -0.69 . . . . 0.46 111.956 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.665 ' HB3' HG23 ' A' ' 85' ' ' ILE . 42.1 mt -64.32 -21.28 66.56 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.381 -0.528 . . . . 1.08 110.395 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.519 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -85.19 -15.29 44.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 1.93 110.641 173.468 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -115.02 4.45 14.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 2.12 111.428 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.62 HG23 ' HB ' ' A' ' 80' ' ' ILE . 9.7 t -72.93 114.34 29.82 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 121.758 0.79 . . . . 0.94 109.968 -175.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 6.2 Cg_exo -72.94 -22.16 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 123.039 2.492 . . . . 1.0 113.499 -165.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 30.2 m -112.85 17.4 19.01 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.09 0.774 . . . . 1.49 113.09 -173.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.62 ' HB ' HG23 ' A' ' 77' ' ' THR . 41.0 mm -118.3 135.9 57.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.115 0.484 . . . . 1.21 111.724 -177.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.3 p -75.89 148.91 37.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.743 -0.662 . . . . 1.79 110.344 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -57.06 -34.48 68.3 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.848 -1.069 . . . . 2.89 112.962 -169.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -70.29 -42.69 71.72 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.144 -0.222 . . . . 2.06 111.309 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.597 ' O ' HG13 ' A' ' 88' ' ' ILE . 25.3 mt-30 -60.93 -34.46 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.934 0.397 . . . . 2.31 110.13 177.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.665 HG23 ' HB3' ' A' ' 74' ' ' LEU . 60.4 mt -60.69 -51.15 76.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 1.41 110.049 175.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.555 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 27.1 ttpt -54.64 -42.47 71.29 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.831 -0.622 . . . . 2.45 110.512 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.44 -35.96 79.03 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.183 -0.917 . . . . 1.7 111.714 -175.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.625 HG12 HG13 ' A' ' 33' ' ' ILE . 62.9 mt -70.94 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 112.273 0.471 . . . . 0.42 112.273 -177.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.667 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -103.4 -18.9 14.63 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.613 0.968 . . . . 0.75 113.613 -166.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.555 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 60.4 t80 -77.05 -38.94 51.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.864 0.364 . . . . 1.13 110.632 -175.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 43.4 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 121.251 0.548 . . . . 0.86 110.843 -179.451 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 . . . . . 0 N--CA 1.451 -0.376 0 CA-C-O 122.032 0.92 . . . . 1.79 109.33 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.415 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.8 m -58.95 128.55 37.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.873 -1.058 . . . . 1.33 110.242 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.809 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 49.9 mt-30 -53.23 -34.15 55.91 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.551 -0.75 . . . . 1.88 112.229 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.2 -48.21 68.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.833 0.349 . . . . 2.17 110.529 178.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -70.1 -35.85 74.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 2.55 110.727 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.696 ' O ' HG12 ' A' ' 15' ' ' ILE . 75.0 t -57.88 -56.49 15.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.05 -0.352 . . . . 0.39 110.05 176.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.43 -37.82 70.73 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.356 0.598 . . . . 0.35 110.962 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -61.57 -39.07 89.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.284 -0.871 . . . . 0.86 111.161 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HG2' ' HD2' ' A' ' 18' ' ' ARG . 33.3 tt0 -77.78 -41.2 38.21 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.034 0.383 . . . . 2.05 112.034 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.696 HG12 ' O ' ' A' ' 11' ' ' VAL . 7.0 mm -55.91 -50.85 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.029 0.443 . . . . 0.33 110.336 -175.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.645 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 7.8 p -57.59 -39.59 77.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.396 -0.82 . . . . 0.32 111.313 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -66.46 -45.58 79.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.116 -0.493 . . . . 0.59 110.88 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.406 ' HD2' ' HG2' ' A' ' 14' ' ' GLU . 34.2 mtp180 -65.42 -43.21 91.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.91 -0.586 . . . . 2.83 111.723 -175.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.589 HD12 ' HA2' ' A' ' 67' ' ' GLY . 3.3 mm? -83.05 -7.57 59.64 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.14 0.422 . . . . 0.99 112.14 -178.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 56.16 37.18 28.58 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.009 -1.108 . . . . 1.6 108.009 -169.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.788 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 5.5 tp10 -60.84 117.02 21.37 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 113.168 -1.833 . . . . 1.31 111.309 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.47 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 48.9 Cg_endo -64.16 -44.17 13.02 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 123.708 2.939 . . . . 0.41 112.862 174.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.528 ' HG3' ' OE2' ' A' ' 21' ' ' GLU . 0.0 OUTLIER -104.49 72.37 1.04 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.74 1.257 . . . . 1.41 110.014 -175.792 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.494 ' O ' HG22 ' A' ' 27' ' ' ILE . 31.6 mtmm -66.12 -18.38 65.31 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.565 -1.652 . . . . 1.75 112.707 -167.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.21 -33.08 69.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.124 0.487 . . . . 2.14 109.732 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.903 HD11 ' HA ' ' A' ' 89' ' ' PHE . 8.7 tt -73.95 -40.51 63.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 1.33 110.26 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.788 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.9 tp -62.97 -29.73 47.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.651 -0.499 . . . . 0.44 109.651 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.656 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.37 -34.74 63.42 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.403 0.62 . . . . 0.21 110.285 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.9 ttm180 -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.556 -0.747 . . . . 1.48 111.125 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.67 ' O ' HG12 ' A' ' 34' ' ' ILE . 19.9 t -53.22 -46.37 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 N-CA-C 109.114 -0.698 . . . . 1.1 109.114 176.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.656 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -52.84 -50.33 43.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.153 -1.385 . . . . 0.22 111.337 175.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 -61.02 -49.7 76.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.733 -0.667 . . . . 3.75 111.627 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.581 HD12 HG12 ' A' ' 88' ' ' ILE . 35.8 mt -73.89 -51.94 22.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.713 0.634 . . . . 0.8 112.713 -171.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 30' ' ' VAL . 28.8 pt -83.81 -28.68 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.058 -0.657 . . . . 0.4 111.328 -176.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.97 149.8 8.64 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.596 -0.811 . . . . 0.26 111.66 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.809 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 1.6 p-10 -60.32 -41.34 93.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.078 0.399 . . . . 0.91 112.078 -177.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -71.79 -34.81 69.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.005 0.431 . . . . 3.19 110.237 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.849 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 21.5 mtpp -69.69 -25.03 63.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.122 -0.49 . . . . 2.45 110.992 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.64 -36.42 80.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.199 0.523 . . . . 0.29 109.606 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.41 -40.78 64.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.588 -0.733 . . . . 1.13 111.441 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.849 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 12.8 pt-20 -67.17 -31.81 72.48 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.726 -0.39 . . . . 2.1 110.443 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.823 ' HB3' HD13 ' A' ' 73' ' ' LEU . 28.6 mt -69.39 -41.91 75.84 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.349 -0.612 . . . . 0.29 109.349 171.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.62 -32.85 65.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.811 -0.631 . . . . 1.36 111.808 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 80.1 mtp -75.31 -42.36 54.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.136 0.493 . . . . 2.2 110.353 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -70.23 -25.05 63.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.799 -0.637 . . . . 1.83 111.369 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.566 HG23 HD11 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -56.04 -36.73 68.34 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 110.087 -0.338 . . . . 1.03 110.087 178.505 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.54 -34.4 77.83 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.075 -0.511 . . . . 0.88 110.975 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.639 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 43.9 mt-10 -71.12 -42.82 68.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.925 -0.58 . . . . 2.51 110.059 178.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.63 -33.39 63.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.013 -0.54 . . . . 0.76 109.813 176.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 3.7 tm-20 -61.66 -51.25 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.489 -0.778 . . . . 1.96 109.662 175.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.639 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.8 pt20 -64.84 -18.0 64.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.861 0.362 . . . . 2.25 111.3 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -99.06 -7.88 26.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.546 -0.297 . . . . 2.34 111.696 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.24 35.55 91.72 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 121.176 -0.535 . . . . 1.33 112.81 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -97.16 109.27 3.81 Favored Glycine 0 C--O 1.226 -0.358 0 C-N-CA 120.598 -0.81 . . . . 0.89 113.785 -174.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.914 HD11 HG23 ' A' ' 57' ' ' ILE . 2.6 tm? -176.82 124.47 0.15 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.122 0.487 . . . . 1.38 110.836 169.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.457 ' N ' HD22 ' A' ' 55' ' ' LEU . 97.2 m-85 -126.0 100.89 6.55 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.132 -1.062 . . . . 2.87 108.132 164.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.914 HG23 HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -72.03 -176.15 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.012 0.375 . . . . 0.68 112.012 -176.687 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -41.22 -45.61 2.92 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.912 -1.04 . . . . 0.91 112.573 -179.414 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.609 ' H ' HD22 ' A' ' 59' ' ' ASN . 0.1 OUTLIER -94.92 -34.88 12.24 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.551 0.575 . . . . 2.28 112.551 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.75 -17.08 32.77 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.422 -0.418 . . . . 1.21 113.181 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.57 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 68.6 m -64.12 -57.61 9.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.689 0.281 . . . . 2.18 111.683 -178.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.552 ' O ' HD11 ' A' ' 57' ' ' ILE . 68.7 ttt180 -81.59 81.55 7.63 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.907 -0.775 . . . . 2.89 108.907 174.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -71.41 126.96 31.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.774 -0.648 . . . . 3.59 111.167 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.752 ' HD2' HG22 ' A' ' 69' ' ' VAL . 0.1 OUTLIER 70.08 58.0 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.703 1.001 . . . . 1.98 113.703 172.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.763 HG23 ' HA3' ' A' ' 68' ' ' GLY . 3.7 t -78.64 143.33 62.95 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.221 -0.9 . . . . 0.44 109.152 169.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.433 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.3 Cg_endo -46.25 -59.61 1.15 Allowed 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 124.134 3.222 . . . . 0.44 113.477 -174.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.589 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -68.25 -34.55 80.74 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.329 -0.939 . . . . 0.25 111.316 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.763 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.31 -38.65 79.58 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 114.981 -0.61 . . . . 0.3 112.114 177.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.752 HG22 ' HD2' ' A' ' 64' ' ' ARG . 22.0 t -59.67 -41.44 85.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.129 0.49 . . . . 0.74 110.204 178.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.63 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 21.1 t80 -65.73 -36.83 84.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.26 110.484 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -57.63 -36.77 72.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.755 -0.831 . . . . 0.32 108.755 176.819 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.882 ' HB2' HD23 ' A' ' 55' ' ' LEU . 66.5 t30 -63.05 -27.7 69.59 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.453 -0.794 . . . . 1.08 110.549 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.823 HD13 ' HB3' ' A' ' 42' ' ' LEU . 45.5 mt -58.22 -35.41 71.63 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.148 -0.478 . . . . 0.46 111.763 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.861 ' HB3' HG23 ' A' ' 85' ' ' ILE . 7.2 mp -64.4 -19.78 65.72 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.089 -0.505 . . . . 1.08 110.616 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.401 ' N ' ' HE2' ' A' ' 75' ' ' LYS . 0.0 OUTLIER -82.66 -40.11 21.16 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.927 0.394 . . . . 1.93 110.151 175.655 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -89.04 11.19 19.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.775 -0.648 . . . . 2.12 110.872 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.578 HG21 ' HB ' ' A' ' 80' ' ' ILE . 14.7 t -64.28 131.79 95.14 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 121.752 0.787 . . . . 0.94 109.946 -177.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.508 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.5 Cg_exo -72.72 -47.5 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.284 2.656 . . . . 1.0 113.851 -169.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.2 m -113.53 16.76 18.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.499 0.926 . . . . 1.49 113.499 -172.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.578 ' HB ' HG21 ' A' ' 77' ' ' THR . 61.4 mt -119.1 138.92 48.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.57 -0.452 . . . . 1.21 111.172 -174.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.3 p -98.28 167.2 11.0 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.063 0.458 . . . . 1.79 111.861 -177.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.455 ' H ' ' CD ' ' A' ' 82' ' ' GLU . 1.6 mp0 -51.9 -48.64 64.04 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.14 1.163 . . . . 2.89 114.14 -167.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -68.07 -37.09 80.86 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.567 -0.453 . . . . 2.06 111.796 -173.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.493 ' O ' HG13 ' A' ' 88' ' ' ILE . 43.1 mt-30 -62.22 -37.19 84.41 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.542 0.687 . . . . 2.31 109.26 175.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.861 HG23 ' HB3' ' A' ' 74' ' ' LEU . 82.4 mt -68.39 -49.49 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 114.637 -1.165 . . . . 1.41 110.934 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.546 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 39.3 ttmt -57.25 -41.45 79.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.887 -0.597 . . . . 2.45 111.538 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . 0.408 ' HA ' ' CD1' ' A' ' 91' ' ' ILE . 27.5 t70 -60.11 -32.92 71.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.005 0.431 . . . . 1.7 111.161 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.581 HG12 HD12 ' A' ' 33' ' ' ILE . 51.8 mt -70.83 -70.84 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.941 -0.572 . . . . 0.42 112.318 -177.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.903 ' HA ' HD11 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -106.89 -12.9 15.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 113.254 0.835 . . . . 0.75 113.254 -164.585 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.546 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 76.3 t80 -90.28 -38.14 13.6 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.793 0.33 . . . . 1.13 110.911 -172.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.408 ' CD1' ' HA ' ' A' ' 87' ' ' ASP . 51.4 mt . . . . . 0 C--N 1.327 -0.409 0 CA-C-N 116.426 -0.352 . . . . 0.86 110.423 178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 . . . . . 0 N--CA 1.452 -0.363 0 N-CA-C 109.325 -0.62 . . . . 1.79 109.325 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.475 ' O ' HG23 ' A' ' 11' ' ' VAL . 39.1 t -63.31 119.23 9.25 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.648 -0.501 . . . . 1.33 109.648 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.839 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 16.1 mt-30 -55.87 -29.89 60.66 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.346 0.498 . . . . 1.88 112.346 -173.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -65.38 -50.17 66.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.084 0.469 . . . . 2.17 110.287 176.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . 0.566 ' HE3' ' HB3' ' A' ' 13' ' ' ASP . 0.3 OUTLIER -70.25 -37.45 74.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.918 -0.583 . . . . 2.55 109.885 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.676 ' O ' HG12 ' A' ' 15' ' ' ILE . 69.5 t -57.14 -47.62 83.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.228 -0.286 . . . . 0.39 110.228 177.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.23 -42.86 70.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.206 0.527 . . . . 0.35 111.029 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.566 ' HB3' ' HE3' ' A' ' 10' ' ' LYS . 35.8 t70 -70.37 -39.73 74.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.687 -0.688 . . . . 0.86 110.537 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 18' ' ' ARG . 7.6 tp10 -61.46 -45.2 95.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.118 -0.947 . . . . 2.05 111.292 -177.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.676 HG12 ' O ' ' A' ' 11' ' ' VAL . 5.2 mm -59.98 -52.17 64.33 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-O 121.067 0.461 . . . . 0.33 109.925 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.624 ' HB3' HG21 ' A' ' 27' ' ' ILE . 19.4 p -64.95 -38.88 92.45 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.642 -0.708 . . . . 0.32 111.32 -175.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -59.23 -45.61 90.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.783 -0.644 . . . . 0.59 110.949 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 14' ' ' GLU . 75.0 mtt180 -79.04 -33.7 44.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.603 -0.272 . . . . 2.83 111.529 -177.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.941 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.2 mm? -79.29 -9.4 59.57 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.445 0.535 . . . . 0.99 112.445 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 58.57 34.65 24.03 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 108.079 -1.082 . . . . 1.6 108.079 -171.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.524 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 1.3 tm-20 -71.8 126.07 91.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 114.089 -1.414 . . . . 1.31 111.91 -165.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.46 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 73.6 Cg_endo -69.93 -46.65 1.08 Allowed 'Trans proline' 0 N--CA 1.476 0.463 0 C-N-CA 124.657 3.571 . . . . 0.41 114.345 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.46 ' HG2' ' HG2' ' A' ' 22' ' ' PRO . 33.0 pttt -109.85 66.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.382 0.611 . . . . 1.41 110.494 -169.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.551 ' HA ' HG22 ' A' ' 27' ' ' ILE . 83.6 mttt -59.32 -12.44 5.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.523 -1.217 . . . . 1.75 113.411 -167.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.13 -46.61 86.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.374 0.607 . . . . 2.14 109.662 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.61 HD11 ' HA ' ' A' ' 89' ' ' PHE . 6.6 tt -73.36 -41.57 63.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.289 -0.868 . . . . 1.33 110.812 -177.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.624 HG21 ' HB3' ' A' ' 16' ' ' SER . 6.4 tp -65.87 -30.04 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 121.004 0.43 . . . . 0.44 110.413 -177.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.703 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.18 -33.82 63.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.579 0.704 . . . . 0.21 110.333 173.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 33' ' ' ILE . 38.7 ttm180 -63.03 -39.15 93.89 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.296 -0.865 . . . . 1.48 111.763 -179.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.662 HG21 ' HE1' ' A' ' 70' ' ' PHE . 23.1 t -52.78 -43.16 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.128 -0.693 . . . . 1.1 109.128 177.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.703 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.0 t -53.18 -50.07 48.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.278 -1.328 . . . . 0.22 110.855 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -59.49 -43.82 93.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.22 -0.9 . . . . 3.75 111.429 -177.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.778 HG13 HG12 ' A' ' 88' ' ' ILE . 38.9 mm -75.55 -49.73 26.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.672 . . . . 0.8 112.5 -173.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 30' ' ' VAL . 36.4 pt -94.76 -29.07 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.604 0.594 . . . . 0.4 112.604 -172.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.33 162.17 10.81 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.556 -0.83 . . . . 0.26 112.673 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.839 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 20.4 p-10 -67.59 -55.99 11.21 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.515 0.326 . . . . 0.91 111.667 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.56 -33.85 69.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.869 -0.419 . . . . 3.19 109.869 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 5.9 mmmm -56.83 -38.3 72.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.855 -0.611 . . . . 2.45 110.914 176.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.451 ' O ' HD22 ' A' ' 43' ' ' LEU . . . -71.42 -38.85 71.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.29 110.869 177.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.805 ' HA ' HD23 ' A' ' 43' ' ' LEU . 22.3 mt -71.42 -33.26 49.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.45 -0.341 . . . . 1.13 111.308 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.46 -33.76 74.3 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.995 0.426 . . . . 2.1 110.179 173.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.839 HD22 ' HB3' ' A' ' 73' ' ' LEU . 79.0 mt -62.73 -36.7 83.84 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.914 -0.585 . . . . 0.29 110.47 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.805 HD23 ' HA ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -57.47 -32.73 67.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.575 0.226 . . . . 1.36 111.036 178.222 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 78.7 mmm -71.41 -39.52 71.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.993 0.425 . . . . 2.2 110.544 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.88 -24.46 62.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.129 -0.487 . . . . 1.83 111.886 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.601 HG22 HD11 ' A' ' 73' ' ' LEU . 43.1 p -54.47 -42.36 70.6 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.55 -0.46 . . . . 1.03 109.877 175.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.25 -39.99 76.72 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.107 -0.497 . . . . 0.88 111.032 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.86 -46.91 85.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.629 -0.714 . . . . 2.51 110.655 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 47.5 t -76.4 -32.08 21.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.339 -0.392 . . . . 0.76 111.263 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.883 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 22.2 mt-10 -67.35 -38.94 85.63 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.913 0.338 . . . . 1.96 111.913 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.07 -19.05 62.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.852 0.358 . . . . 2.25 111.224 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -106.31 -25.06 12.1 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.286 -0.415 . . . . 2.34 112.088 -176.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.86 50.21 9.23 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 116.007 -0.542 . . . . 1.33 113.6 174.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -109.7 118.43 5.13 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.123 -1.036 . . . . 0.89 114.606 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.729 ' HB3' ' HA ' ' A' ' 64' ' ' ARG . 46.6 tp -177.97 131.63 0.15 Allowed 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.471 0.545 . . . . 1.38 112.471 168.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -124.65 101.52 7.16 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.107 -1.071 . . . . 2.87 108.107 165.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.543 HD11 ' C ' ' A' ' 62' ' ' ARG . 0.0 OUTLIER -68.85 -167.23 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 113.595 0.961 . . . . 0.68 113.595 -169.422 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -41.58 -48.01 3.94 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.534 -1.212 . . . . 0.91 111.52 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.576 HD22 ' N ' ' A' ' 61' ' ' SER . 4.2 t30 -116.02 -37.01 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.41 . . . . 2.28 111.008 173.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.507 ' HA2' HG13 ' A' ' 57' ' ' ILE . . . 98.69 8.02 54.91 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.23 -0.986 . . . . 1.21 111.354 -171.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.576 ' N ' HD22 ' A' ' 59' ' ' ASN . 5.3 p -54.66 -53.7 51.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.319 0.58 . . . . 2.18 110.867 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.543 ' C ' HD11 ' A' ' 57' ' ' ILE . 5.0 ptp180 -112.12 53.58 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.6 -0.889 . . . . 2.89 108.6 171.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . 0.458 ' HA ' ' CG1' ' A' ' 57' ' ' ILE . 14.9 ptp180 -50.36 132.42 24.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.786 -1.097 . . . . 3.59 112.211 -168.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.883 ' NH2' ' HA ' ' A' ' 50' ' ' GLU . 19.3 tpt85 68.26 44.82 1.32 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.992 0.901 . . . . 1.98 111.251 174.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.698 ' O ' HG23 ' A' ' 69' ' ' VAL . 4.7 t -74.14 144.01 81.25 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.891 -1.049 . . . . 0.44 110.176 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -46.27 -59.54 1.18 Allowed 'Trans proline' 0 N--CA 1.485 1.016 0 C-N-CA 124.365 3.377 . . . . 0.44 113.883 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.941 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -66.97 -35.3 89.25 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.267 -0.968 . . . . 0.25 111.115 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.648 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -58.33 -32.61 68.37 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.821 -0.689 . . . . 0.3 112.227 176.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.824 HG22 ' HD2' ' A' ' 64' ' ' ARG . 17.1 t -63.71 -35.04 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 CA-C-O 121.223 0.535 . . . . 0.74 110.561 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.662 ' HE1' HG21 ' A' ' 30' ' ' VAL . 14.5 t80 -65.29 -35.6 81.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.887 -0.597 . . . . 0.26 109.813 174.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.532 ' N ' HD23 ' A' ' 71' ' ' LEU . 0.3 OUTLIER -60.21 -34.8 74.15 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.961 -1.125 . . . . 0.32 107.961 177.228 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.685 ' HB2' HD13 ' A' ' 55' ' ' LEU . 54.1 t30 -63.08 -27.13 69.18 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.326 -0.852 . . . . 1.08 110.072 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.839 ' HB3' HD22 ' A' ' 42' ' ' LEU . 67.7 mt -61.05 -33.4 73.24 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.834 -0.621 . . . . 0.46 111.253 175.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.763 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.4 mp -63.98 -20.38 65.85 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.143 -0.48 . . . . 1.08 109.983 175.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.823 ' HZ1' HG21 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -85.11 -45.26 12.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.363 0.602 . . . . 1.93 109.837 172.046 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -81.58 9.11 8.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.133 -0.94 . . . . 2.12 111.379 -176.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.622 ' CG2' ' HB ' ' A' ' 80' ' ' ILE . 9.9 t -68.47 122.47 84.64 Favored Pre-proline 0 N--CA 1.446 -0.668 0 N-CA-C 108.899 -0.778 . . . . 0.94 108.899 176.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 21.1 Cg_exo -65.87 -39.33 20.12 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.839 2.36 . . . . 1.0 113.629 -164.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 19.5 m -113.23 5.66 17.07 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.298 0.851 . . . . 1.49 113.298 -175.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.622 ' HB ' ' CG2' ' A' ' 77' ' ' THR . 62.7 mt -113.24 138.94 41.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 121.862 -0.524 . . . . 1.21 111.283 -174.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.2 p -97.12 155.15 16.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.436 0.636 . . . . 1.79 111.656 -177.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 57.3 mm-40 -59.37 -27.03 65.59 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.076 1.139 . . . . 2.89 114.076 -171.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.85 -43.92 86.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.676 0.671 . . . . 2.06 110.916 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.453 ' O ' HG13 ' A' ' 88' ' ' ILE . 75.6 mm-40 -67.36 -26.52 66.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.79 0.805 . . . . 2.31 109.157 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.823 HG21 ' HZ1' ' A' ' 75' ' ' LYS . 51.1 mm -75.9 -38.92 37.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.464 -1.244 . . . . 1.41 112.113 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 82' ' ' GLU . 8.0 mttm -57.7 -43.29 85.07 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 108.71 -0.848 . . . . 2.45 108.71 177.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -59.32 -32.89 70.49 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.885 -1.507 . . . . 1.7 109.862 -175.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.778 HG12 HG13 ' A' ' 33' ' ' ILE . 49.1 mt -71.94 -64.94 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.995 -1.002 . . . . 0.42 112.22 178.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.722 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -108.32 -19.05 13.6 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 114.77 1.396 . . . . 0.75 114.77 -167.368 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.722 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 89.3 t80 -76.88 -34.11 57.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.396 0.543 . . . . 1.13 110.454 -174.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.6 mt . . . . . 0 C--N 1.327 -0.376 0 CA-C-N 116.054 -0.521 . . . . 0.86 110.325 178.423 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 121.933 0.873 . . . . 1.79 109.303 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -73.94 139.6 45.01 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.783 -0.821 . . . . 1.33 108.783 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.614 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 61.2 mt-30 -48.54 -45.77 37.9 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.974 0.731 . . . . 1.88 112.974 -169.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -63.67 -42.76 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 2.17 110.706 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -70.39 -37.13 74.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.04 0.448 . . . . 2.55 110.044 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.704 HG13 HD11 ' A' ' 15' ' ' ILE . 49.3 t -56.66 -51.91 60.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.634 -0.712 . . . . 0.39 110.865 177.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.18 -33.94 59.31 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.156 0.503 . . . . 0.35 111.206 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -70.38 -41.66 72.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.824 -0.625 . . . . 0.86 110.789 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -72.89 -42.63 63.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.372 -0.376 . . . . 2.05 111.597 -175.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.865 HD12 HD21 ' A' ' 43' ' ' LEU . 1.3 mm -58.68 -48.04 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 120.34 -0.544 . . . . 0.33 110.209 -177.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.666 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 21.7 p -64.57 -34.61 78.67 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.667 -0.697 . . . . 0.32 110.899 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -68.49 -44.06 75.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.196 -0.457 . . . . 0.59 110.481 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -69.46 -46.28 67.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.906 -0.588 . . . . 2.83 111.72 -176.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.842 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.2 mm? -85.1 1.43 47.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.087 0.402 . . . . 0.99 112.087 -175.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 55.68 33.17 20.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.241 0.543 . . . . 1.6 109.561 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.694 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.08 116.77 18.77 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 114.623 -1.171 . . . . 1.31 112.694 -168.031 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.472 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 52.5 Cg_endo -63.45 -40.26 32.15 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 124.011 3.141 . . . . 0.41 113.33 172.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.504 ' HG3' ' OE1' ' A' ' 21' ' ' GLU . 41.9 pttt -109.0 68.56 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.824 0.821 . . . . 1.41 109.463 -172.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.679 ' HA ' HG22 ' A' ' 27' ' ' ILE . 50.4 mttp -62.77 -12.56 24.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.68 -1.146 . . . . 1.75 113.542 -166.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -75.42 -33.85 60.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.117 0.484 . . . . 2.14 110.115 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.63 HD11 ' HA ' ' A' ' 89' ' ' PHE . 0.6 OUTLIER -73.57 -47.33 41.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 1.33 110.171 -178.548 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.694 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 11.0 tp -62.97 -29.43 47.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.216 -0.447 . . . . 0.44 110.895 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.658 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.94 -33.42 63.91 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.061 0.457 . . . . 0.21 110.673 174.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 88' ' ' ILE . 14.0 ttm180 -58.15 -40.15 80.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.032 -0.531 . . . . 1.48 110.874 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.539 HG21 ' HE1' ' A' ' 70' ' ' PHE . 23.3 t -53.06 -44.7 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.487 0.66 . . . . 1.1 109.535 177.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.658 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 82.0 t -52.95 -50.37 44.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 114.19 -1.368 . . . . 0.22 111.149 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -66.07 -41.92 90.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.298 -0.865 . . . . 3.75 111.14 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.493 HG13 HG12 ' A' ' 88' ' ' ILE . 50.1 mm -74.67 -50.27 26.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.897 -0.592 . . . . 0.8 112.541 -172.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.527 HG12 ' O ' ' A' ' 30' ' ' VAL . 33.1 pt -95.56 -29.49 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.106 -0.638 . . . . 0.4 111.902 -174.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.33 160.81 10.98 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.401 -0.904 . . . . 0.26 112.651 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.614 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 3.0 p-10 -67.84 -48.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.49 0.186 . . . . 0.91 111.409 -177.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.412 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 19.4 ptmt -71.73 -33.09 68.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.067 0.461 . . . . 3.19 109.876 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -64.31 -32.2 73.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.016 -0.538 . . . . 2.45 109.844 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.24 -42.52 75.53 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.869 -0.605 . . . . 0.29 109.991 173.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.772 ' HA ' ' HG ' ' A' ' 43' ' ' LEU . 44.8 mm -59.96 -37.68 73.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 120.921 0.391 . . . . 1.13 110.672 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 14.4 mm-40 -54.33 -46.45 72.9 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.236 -0.653 . . . . 2.1 109.236 173.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.944 HD22 ' HB3' ' A' ' 73' ' ' LEU . 72.2 mt -65.63 -43.18 90.29 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.268 -0.878 . . . . 0.29 111.279 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.865 HD21 HD12 ' A' ' 15' ' ' ILE . 4.8 mt -56.68 -38.74 72.65 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.024 0.44 . . . . 1.36 110.334 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 tpp -74.69 -39.78 61.77 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.215 -0.448 . . . . 2.2 109.926 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 40.6 mt-10 -70.01 -23.69 63.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.721 -0.672 . . . . 1.83 112.172 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.54 HG23 ' O ' ' A' ' 42' ' ' LEU . 71.6 p -51.1 -49.11 61.35 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.715 0.293 . . . . 1.03 110.25 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.62 82.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.724 -0.671 . . . . 0.88 111.481 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 36.6 mt-10 -66.94 -40.22 87.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.153 0.502 . . . . 2.51 110.389 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -76.85 -33.51 21.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.065 -0.516 . . . . 0.76 110.495 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 46' ' ' THR . 40.5 mt-10 -58.44 -51.47 69.71 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.344 -0.389 . . . . 1.96 111.27 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 5.3 pp0? -63.72 -22.76 67.07 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 123.371 0.419 . . . . 2.25 111.085 -176.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -89.47 -12.65 39.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.341 0.591 . . . . 2.34 110.394 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.45 28.93 64.75 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.673 -0.694 . . . . 1.33 112.488 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.422 ' O ' ' HB2' ' A' ' 55' ' ' LEU . . . -89.48 101.27 2.75 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.678 -0.772 . . . . 0.89 113.889 -174.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 1.11 HD11 HG23 ' A' ' 57' ' ' ILE . 2.7 tm? -176.62 124.57 0.17 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.102 0.477 . . . . 1.38 111.268 170.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -124.6 105.03 9.04 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.24 -1.022 . . . . 2.87 108.24 164.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.11 HG23 HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -77.5 -179.45 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 112.583 0.586 . . . . 0.68 112.583 -171.02 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -52.47 -43.93 65.28 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.778 -0.646 . . . . 0.91 111.481 -176.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -90.49 -37.54 13.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 2.28 110.989 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 83.75 -14.87 39.83 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.163 -0.541 . . . . 1.21 112.703 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -57.78 11.51 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.892 0.377 . . . . 2.18 111.253 -176.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -96.41 55.69 1.5 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.536 0.684 . . . . 2.89 109.605 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.5 ptt180 -53.89 146.36 14.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.127 -0.942 . . . . 3.59 111.795 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.643 ' H ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER 61.95 49.83 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.629 -1.169 . . . . 1.98 112.621 -177.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.864 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.8 t -75.51 142.01 73.78 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.256 -0.883 . . . . 0.44 109.457 169.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -47.31 -59.12 1.37 Allowed 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 123.831 3.021 . . . . 0.44 112.808 -175.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.842 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -62.65 -39.19 97.59 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.018 -0.833 . . . . 0.25 111.018 177.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.864 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.79 -31.97 61.44 Favored Glycine 0 N--CA 1.447 -0.579 0 CA-C-N 114.866 -0.667 . . . . 0.3 112.868 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 65' ' ' THR . 11.0 t -66.13 -38.33 81.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.124 0.487 . . . . 0.74 109.891 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.539 ' HE1' HG21 ' A' ' 30' ' ' VAL . 5.9 t80 -66.41 -38.69 88.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.162 -0.472 . . . . 0.26 109.932 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -57.0 -34.52 68.23 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.83 -0.804 . . . . 0.32 108.83 176.19 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.831 ' HB2' HD23 ' A' ' 55' ' ' LEU . 6.0 t30 -59.59 -38.94 82.56 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.559 -0.746 . . . . 1.08 110.154 176.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.944 ' HB3' HD22 ' A' ' 42' ' ' LEU . 70.9 mt -58.35 -35.06 71.37 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.55 -0.75 . . . . 0.46 112.084 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.594 ' HB3' HG23 ' A' ' 85' ' ' ILE . 14.7 mt -57.54 -47.02 83.14 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.326 -0.397 . . . . 1.08 110.961 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . 0.645 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.1 OUTLIER -93.03 -7.75 44.86 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.142 -0.623 . . . . 1.93 111.808 -179.091 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -98.82 -18.0 18.17 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.221 -0.445 . . . . 2.12 111.013 -178.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.535 HG21 HD12 ' A' ' 80' ' ' ILE . 10.1 t -58.6 126.22 78.93 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.698 0.761 . . . . 0.94 110.973 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.2 Cg_exo -73.91 -25.75 13.93 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 123.31 2.674 . . . . 1.0 113.282 -171.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.0 t -101.35 -2.54 30.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.175 0.435 . . . . 1.49 112.175 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.535 HD12 HG21 ' A' ' 77' ' ' THR . 36.2 mt -119.29 136.87 55.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 121.931 -0.481 . . . . 1.21 110.911 -176.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -85.25 153.87 22.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.182 0.515 . . . . 1.79 110.578 -176.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.86 -30.35 71.45 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.306 -0.861 . . . . 2.89 112.942 -167.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.41 -36.88 79.74 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.94 -0.304 . . . . 2.06 111.437 -176.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -66.2 -36.08 82.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.61 0.719 . . . . 2.31 109.536 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 74' ' ' LEU . 45.8 mm -74.97 -36.62 39.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.878 -1.056 . . . . 1.41 111.629 -177.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.537 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 23.0 ttmm -51.55 -39.22 57.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 2.45 111.49 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -71.41 -33.1 69.14 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.053 -0.521 . . . . 1.7 111.498 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.501 HG21 HG22 ' A' ' 30' ' ' VAL . 57.7 mt -65.96 -67.7 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 112.569 0.581 . . . . 0.42 112.569 -170.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.826 ' H ' ' HD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -112.05 -27.56 8.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.466 0.543 . . . . 0.75 112.466 -170.596 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.537 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.7 t80 -67.35 -36.35 81.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.109 0.481 . . . . 1.13 111.233 -172.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.6 mt . . . . . 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 0.86 110.279 177.39 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 121.677 0.751 . . . . 1.79 110.41 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.454 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.8 m -64.94 130.92 45.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.596 -0.729 . . . . 1.33 110.289 177.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.776 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.7 mt-30 -51.43 -47.05 63.13 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.905 0.705 . . . . 1.88 112.905 -167.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.61 -46.7 87.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.407 0.146 . . . . 2.17 110.956 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -58.72 -41.63 86.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.035 0.445 . . . . 2.55 109.962 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' VAL . . . . . 0.665 ' O ' HG12 ' A' ' 15' ' ' ILE . 78.3 t -60.03 -57.74 10.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.499 -0.773 . . . . 0.39 110.772 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.13 -38.23 70.54 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.291 0.567 . . . . 0.35 111.276 -176.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -39.29 89.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.434 -0.803 . . . . 0.86 110.665 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -76.71 -38.31 54.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.119 -0.491 . . . . 2.05 112.038 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.668 HG22 HD23 ' A' ' 19' ' ' LEU . 2.2 mm -61.28 -47.34 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 C-N-CA 120.376 -0.529 . . . . 0.33 110.036 -177.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . 0.581 ' HB3' HG21 ' A' ' 27' ' ' ILE . 17.0 p -58.25 -38.51 77.04 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.944 -0.571 . . . . 0.32 110.791 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -68.69 -45.16 72.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 0.59 110.835 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -67.01 -43.38 83.02 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.238 0.458 . . . . 2.83 112.238 -175.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.668 HD23 HG22 ' A' ' 15' ' ' ILE . 3.6 mm? -79.41 -9.8 59.67 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.566 -0.454 . . . . 0.99 111.249 178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 53.59 31.23 12.15 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.531 -0.914 . . . . 1.6 108.531 -170.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.615 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 19.6 tt0 -69.34 130.13 91.18 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 114.124 -1.398 . . . . 1.31 112.073 -169.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.425 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 43.4 Cg_endo -64.41 -54.84 0.69 Allowed 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 124.352 3.368 . . . . 0.41 113.238 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.499 ' HD2' ' HB3' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -85.61 67.89 10.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.918 0.866 . . . . 1.41 110.657 -176.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.475 ' O ' HG22 ' A' ' 27' ' ' ILE . 77.1 mttt -62.9 -19.69 64.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.518 -1.219 . . . . 1.75 112.143 -172.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.39 -41.62 85.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.195 0.521 . . . . 2.14 110.119 174.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.772 HD21 ' HA ' ' A' ' 89' ' ' PHE . 1.6 tm? -73.1 -42.93 62.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.431 -0.804 . . . . 1.33 110.811 -176.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ILE . . . . . 0.615 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 5.1 tp -61.32 -32.17 52.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.916 0.388 . . . . 0.44 110.375 -177.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ALA . . . . . 0.562 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.25 -35.15 61.44 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.235 -0.439 . . . . 0.21 110.881 174.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.2 ttm-85 -62.31 -41.12 98.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.34 -0.391 . . . . 1.48 111.21 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' VAL . . . . . 0.571 ' O ' HG12 ' A' ' 34' ' ' ILE . 28.8 t -53.83 -45.25 62.3 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.192 0 CA-C-O 121.307 0.575 . . . . 1.1 109.595 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.562 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.5 t -53.21 -51.69 37.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 114.503 -1.226 . . . . 0.22 110.748 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -59.67 -42.64 93.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 3.75 111.709 -177.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.445 HG13 HG12 ' A' ' 88' ' ' ILE . 45.1 mm -74.99 -53.03 17.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 112.882 0.697 . . . . 0.8 112.882 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ILE . . . . . 0.571 HG12 ' O ' ' A' ' 30' ' ' VAL . 29.8 pt -95.71 -7.63 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 112.192 0.441 . . . . 0.4 112.192 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.07 161.91 26.56 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.345 -0.931 . . . . 0.26 112.392 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . 0.776 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 13.8 p-10 -63.84 -42.31 97.63 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 122.377 0.271 . . . . 0.91 111.601 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 39.5 ttpt -67.33 -50.42 60.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.051 -0.26 . . . . 3.19 111.019 -175.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' LYS . . . . . 0.549 ' HB3' HD12 ' A' ' 34' ' ' ILE . 12.2 mmmt -61.47 -26.43 67.88 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.66 0.244 . . . . 2.45 111.66 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.483 ' O ' HD23 ' A' ' 43' ' ' LEU . . . -67.36 -47.66 69.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.01 -0.367 . . . . 0.29 110.01 176.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ILE . . . . . 0.653 ' HA ' HD21 ' A' ' 43' ' ' LEU . 49.4 mm -66.35 -38.15 81.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 120.986 0.422 . . . . 1.13 110.219 177.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 32.9 mm-40 -55.9 -38.89 70.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.814 -0.63 . . . . 2.1 110.051 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.687 HD22 ' HB3' ' A' ' 73' ' ' LEU . 22.0 mt -62.88 -43.42 98.85 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.161 -0.472 . . . . 0.29 112.093 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.653 HD21 ' HA ' ' A' ' 40' ' ' ILE . 0.1 OUTLIER -64.19 -28.58 69.84 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 119.579 -0.849 . . . . 1.36 111.094 178.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.2 mtp -73.9 -36.89 64.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.142 0.496 . . . . 2.2 110.002 170.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.3 mt-10 -65.77 -25.54 67.31 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.659 -0.7 . . . . 1.83 111.706 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' THR . . . . . 0.635 HG22 HD11 ' A' ' 73' ' ' LEU . 68.5 p -55.35 -40.0 70.72 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.868 0.366 . . . . 1.03 110.116 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.92 -32.86 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.88 110.859 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.473 ' HA ' ' HG3' ' A' ' 51' ' ' GLN . 29.1 mt-10 -71.41 -27.99 63.68 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.101 -0.5 . . . . 2.51 109.93 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 56.7 t -69.23 -43.25 81.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.118 0.485 . . . . 0.76 109.767 170.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 46' ' ' THR . 4.6 mm-40 -55.83 -42.99 76.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.42 -0.809 . . . . 1.96 110.44 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.473 ' HG3' ' HA ' ' A' ' 48' ' ' GLU . 5.3 pp0? -82.55 -19.02 39.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.106 -0.497 . . . . 2.25 111.686 -176.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -87.87 -26.7 22.63 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.271 0.471 . . . . 2.34 112.271 -171.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.95 -12.54 2.37 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 119.967 -1.111 . . . . 1.33 113.29 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.33 -133.18 10.95 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.093 -1.051 . . . . 0.89 114.81 171.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 1.072 HD11 HG23 ' A' ' 57' ' ' ILE . 0.6 OUTLIER -162.83 131.94 4.16 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.599 0.36 . . . . 1.38 110.895 -163.467 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PHE . . . . . 0.632 ' N ' HD22 ' A' ' 55' ' ' LEU . 34.6 t80 -116.74 110.55 18.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.269 -1.012 . . . . 2.87 108.269 168.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 1.072 HG23 HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -77.73 -178.41 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.375 0.88 . . . . 0.68 113.375 -170.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.92 -46.53 60.84 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 115.801 -0.636 . . . . 0.91 111.345 -177.206 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.619 HD21 ' HB3' ' A' ' 61' ' ' SER . 0.9 OUTLIER -92.8 -36.74 12.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.081 -0.509 . . . . 2.28 110.212 176.423 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLY . . . . . 0.486 ' H ' HG13 ' A' ' 57' ' ' ILE . . . 84.22 -19.69 16.81 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 114.598 0.599 . . . . 1.21 114.598 169.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.619 ' HB3' HD21 ' A' ' 59' ' ' ASN . 8.4 t -66.7 -45.61 78.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 117.377 0.589 . . . . 2.18 110.412 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.549 ' O ' HD11 ' A' ' 57' ' ' ILE . 20.0 ttt180 -85.48 42.09 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.699 0.761 . . . . 2.89 109.687 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -46.95 132.04 11.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.477 -1.238 . . . . 3.59 113.076 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.732 ' HD3' ' N ' ' A' ' 55' ' ' LEU . 19.2 mmm180 68.42 57.97 0.44 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.754 -1.112 . . . . 1.98 112.238 175.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' THR . . . . . 0.667 HG23 ' HA3' ' A' ' 68' ' ' GLY . 5.3 t -82.73 144.69 49.02 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 114.779 -1.1 . . . . 0.44 108.19 169.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PRO . . . . . 0.561 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.45 -60.35 0.9 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 123.825 3.017 . . . . 0.44 113.746 -173.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.696 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -65.25 -37.22 93.74 Favored Glycine 0 C--O 1.224 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.25 111.163 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.667 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.37 -32.88 61.07 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.123 -0.539 . . . . 0.3 112.705 178.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 65' ' ' THR . 48.3 t -62.6 -40.69 89.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.226 0.536 . . . . 0.74 109.729 176.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . 0.543 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 12.5 t80 -65.24 -36.99 85.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.53 -0.759 . . . . 0.26 109.993 174.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.696 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -57.54 -43.53 84.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.177 -1.046 . . . . 0.32 108.177 177.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ASN . . . . . 0.497 ' HB2' HD23 ' A' ' 55' ' ' LEU . 60.4 t30 -55.93 -26.42 47.72 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.73 0.643 . . . . 1.08 110.924 -178.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.687 ' HB3' HD22 ' A' ' 42' ' ' LEU . 77.0 mt -56.39 -41.59 76.54 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.024 -0.535 . . . . 0.46 111.297 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.877 ' HB3' HG23 ' A' ' 85' ' ' ILE . 6.5 mp -62.47 -19.02 63.12 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.014 0.435 . . . . 1.08 110.784 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 1.1 mppt? -91.62 -23.37 19.88 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.729 0.27 . . . . 1.93 111.729 178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -114.64 -11.99 12.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.675 0.274 . . . . 2.12 111.446 -173.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' THR . . . . . 0.749 HG21 HD12 ' A' ' 80' ' ' ILE . 5.5 t -60.24 132.75 90.35 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 121.661 0.743 . . . . 0.94 111.281 -172.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 3.4 Cg_exo -74.3 -36.97 2.8 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 123.536 2.824 . . . . 1.0 114.676 -167.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 39.6 m -111.88 17.59 19.62 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.135 1.161 . . . . 1.49 114.135 -168.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.749 HD12 HG21 ' A' ' 77' ' ' THR . 44.0 mt -115.2 134.03 59.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 118.289 0.495 . . . . 1.21 110.523 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 41.2 m -75.9 143.98 41.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.651 0.739 . . . . 1.79 111.562 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.424 ' HA ' HD12 ' A' ' 85' ' ' ILE . 42.8 tt0 -52.58 -45.38 66.44 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.061 -1.427 . . . . 2.89 113.632 -168.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.82 -42.12 77.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.944 -0.302 . . . . 2.06 110.919 -177.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.32 -31.71 69.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.46 0.647 . . . . 2.31 110.001 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ILE . . . . . 0.877 HG23 ' HB3' ' A' ' 74' ' ' LEU . 97.3 mt -66.86 -45.85 86.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.776 -1.102 . . . . 1.41 111.404 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 14.0 ttmm -56.27 -39.52 72.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.889 -0.596 . . . . 2.45 111.083 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -66.65 -31.69 72.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.562 -0.745 . . . . 1.7 112.622 -173.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ILE . . . . . 0.445 HG12 HG13 ' A' ' 33' ' ' ILE . 43.3 mt -69.87 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.359 0.503 . . . . 0.42 112.359 -173.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.772 ' HA ' HD21 ' A' ' 26' ' ' LEU . 9.9 p90 -95.59 -20.98 18.54 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.634 0.605 . . . . 0.75 112.634 -164.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 90.7 t80 -93.77 -10.38 34.37 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.298 -0.41 . . . . 1.13 111.865 -165.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt . . . . . 0 C--N 1.325 -0.495 0 C-N-CA 120.686 -0.405 . . . . 0.86 111.768 -176.866 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.885 0 N-CA-C 111.907 -0.477 . . . . 9.19 111.907 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -135.67 -53.49 0.77 Allowed 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.897 0.38 . . . . 7.69 110.963 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 48.2 tpp -111.56 -59.88 1.92 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.087 0.47 . . . . 7.18 110.551 -177.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.424 ' H ' ' H ' ' A' ' 5' ' ' GLU . . . -168.5 -22.07 0.02 OUTLIER 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.609 -0.723 . . . . 4.5 109.701 -178.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.424 ' H ' ' H ' ' A' ' 4' ' ' ALA . 2.9 mm-40 64.09 37.55 9.01 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 114.125 -1.398 . . . . 4.1 109.977 174.077 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.776 ' HB3' HD12 ' A' ' 40' ' ' ILE . 0.5 OUTLIER -74.58 62.7 1.05 Allowed 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.21 -0.905 . . . . 1.79 112.571 -175.371 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.467 ' O ' HG23 ' A' ' 11' ' ' VAL . 28.5 t -74.93 121.8 22.46 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.141 -1.059 . . . . 1.33 108.141 170.048 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 36' ' ' ASN . 0.2 OUTLIER -56.64 -29.91 62.74 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.417 0.525 . . . . 1.88 112.417 -169.533 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -66.68 -47.96 70.81 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 120.907 0.384 . . . . 2.17 110.143 176.178 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.8 tttp -63.31 -40.49 97.49 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.887 -0.597 . . . . 2.55 110.25 175.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.657 ' O ' HG12 ' A' ' 15' ' ' ILE . 93.1 t -57.44 -54.56 29.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.935 -0.575 . . . . 0.39 110.606 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.98 -40.09 75.86 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-O 120.954 0.407 . . . . 0.35 111.576 -179.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -67.71 -32.83 73.74 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.944 -0.571 . . . . 0.86 110.519 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 tp10 -71.8 -48.15 48.47 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.739 -0.664 . . . . 2.05 111.013 179.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.657 HG12 ' O ' ' A' ' 11' ' ' VAL . 1.2 mm -58.38 -50.89 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.332 0 CA-C-O 121.277 0.561 . . . . 0.33 110.012 -178.18 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.557 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 12.7 p -59.08 -37.23 76.59 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.425 -0.807 . . . . 0.32 111.576 -175.092 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.5 t80 -70.71 -44.95 65.88 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.442 -0.344 . . . . 0.59 110.897 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.7 mtp85 -72.42 -29.47 63.74 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.507 0.558 . . . . 2.83 112.507 -173.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.633 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 3.8 mm? -93.97 0.04 55.82 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 120.758 0.313 . . . . 0.99 111.292 178.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 50.47 44.82 26.92 Favored 'General case' 0 C--N 1.341 0.202 0 CA-C-N 115.285 -0.871 . . . . 1.6 109.14 -173.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.842 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -61.26 120.15 52.37 Favored Pre-proline 0 C--N 1.324 -0.521 0 CA-C-N 114.523 -1.217 . . . . 1.31 112.427 -170.514 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.442 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 55.4 Cg_endo -64.46 -39.63 27.8 Favored 'Trans proline' 0 CA--C 1.529 0.273 0 C-N-CA 124.28 3.32 . . . . 0.41 113.084 174.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.544 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 35.2 pttt -120.45 63.8 0.84 Allowed 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.195 0.522 . . . . 1.41 109.948 -172.063 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.4 mttp -56.25 -17.6 8.02 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 114.315 1.228 . . . . 1.75 114.315 -164.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -63.16 -31.22 72.31 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.102 0.477 . . . . 2.14 110.029 175.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.856 HD11 ' HB3' ' A' ' 89' ' ' PHE . 2.2 tm? -73.16 -51.57 17.38 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.573 -0.739 . . . . 1.33 110.387 179.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.842 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 7.3 tp -62.36 -32.29 54.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 CA-C-N 116.231 -0.44 . . . . 0.44 111.03 -177.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.739 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -72.9 -33.0 65.74 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.56 0.695 . . . . 0.21 110.078 174.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.485 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 33.3 ttm180 -63.35 -40.92 98.61 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.23 -0.896 . . . . 1.48 111.908 -179.766 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.67 ' HA ' HD13 ' A' ' 88' ' ' ILE . 33.0 t -53.19 -45.07 54.14 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.264 0 N-CA-C 108.781 -0.822 . . . . 1.1 108.781 177.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.739 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -53.02 -55.75 10.83 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 CA-C-N 114.009 -1.45 . . . . 0.22 111.478 174.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.6 ttt180 -59.53 -40.14 86.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.608 -0.724 . . . . 3.75 111.304 -177.159 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.65 HG13 HG12 ' A' ' 88' ' ' ILE . 47.0 mm -75.3 -53.11 16.87 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 N-CA-C 112.802 0.668 . . . . 0.8 112.802 -176.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.641 HG12 ' O ' ' A' ' 30' ' ' VAL . 28.3 pt -88.06 -29.28 5.44 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.215 0 C-N-CA 120.061 -0.656 . . . . 0.4 112.248 -171.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 130.54 156.2 8.54 Favored Glycine 0 N--CA 1.449 -0.482 0 C-N-CA 120.33 -0.938 . . . . 0.26 112.644 -178.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.581 ' HB3' ' HB3' ' A' ' 8' ' ' GLN . 14.1 p-10 -62.25 -52.02 65.39 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 122.402 0.281 . . . . 0.91 111.568 -179.493 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.51 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 84.8 tttt -71.74 -36.69 70.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.846 0.355 . . . . 3.19 110.25 -179.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.424 ' HB2' HG13 ' A' ' 34' ' ' ILE . 11.1 mmmm -59.18 -29.76 67.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.701 -0.681 . . . . 2.45 111.269 -178.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -72.53 -37.89 68.18 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 120.828 0.347 . . . . 0.29 110.676 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.776 HD12 ' HB3' ' A' ' 6' ' ' ASP . 37.1 mt -72.21 -34.19 48.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.277 0 CA-C-O 120.911 0.386 . . . . 1.13 110.578 178.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.51 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 16.4 mm-40 -55.29 -39.62 70.08 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.219 -0.66 . . . . 2.1 109.219 172.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.814 HD22 ' HB3' ' A' ' 73' ' ' LEU . 66.8 mt -67.4 -35.51 79.44 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-N 115.346 -0.843 . . . . 0.29 111.101 177.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.627 HD21 HD13 ' A' ' 15' ' ' ILE . 0.1 OUTLIER -60.4 -37.23 80.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.906 0.384 . . . . 1.36 111.07 178.307 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.452 ' HE2' ' HA ' ' A' ' 41' ' ' GLU . 39.5 mtm -72.53 -36.49 68.32 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.265 0.555 . . . . 2.2 109.632 177.015 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -71.07 -28.36 64.29 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.538 -0.755 . . . . 1.83 111.317 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.86 HG23 HD11 ' A' ' 73' ' ' LEU . 0.0 OUTLIER -61.0 -35.95 78.19 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 110.235 -0.283 . . . . 1.03 110.235 178.064 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -65.52 -35.07 79.77 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 121.048 0.452 . . . . 0.88 110.714 175.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.57 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 30.2 tt0 -68.31 -39.9 81.85 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.174 0.511 . . . . 2.51 109.657 178.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 82.4 t -69.11 -33.54 59.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.472 0 CA-C-N 115.974 -0.557 . . . . 0.76 110.035 173.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.728 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 2.6 mm-40 -59.96 -44.06 94.65 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.936 -0.575 . . . . 1.96 111.233 177.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.57 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 17.7 pt20 -72.82 -19.73 61.27 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.416 -0.356 . . . . 2.25 111.245 -176.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 46.9 m-80 -100.09 -25.28 14.35 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-O 121.04 0.448 . . . . 2.34 111.766 -178.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.21 41.67 25.81 Favored Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.963 -0.562 . . . . 1.33 113.228 177.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.87 128.99 9.41 Favored Glycine 0 CA--C 1.521 0.409 0 C-N-CA 120.55 -0.833 . . . . 0.89 113.922 -175.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 1.114 HD23 ' HB2' ' A' ' 72' ' ' ASN . 2.2 tm? -177.43 125.78 0.14 Allowed 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.947 0.403 . . . . 1.38 110.43 170.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.53 ' N ' HD22 ' A' ' 55' ' ' LEU . 94.1 m-85 -124.26 108.69 12.51 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 108.498 -0.927 . . . . 2.87 108.498 165.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.847 HG23 HD11 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -82.84 -176.57 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.318 -0.762 0 CA-C-N 116.193 -0.458 . . . . 0.68 111.438 -178.277 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.796 ' HE3' " O3'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -52.81 -36.32 58.25 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 112.999 0.741 . . . . 0.91 112.999 -173.416 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.595 ' OD1' ' HB2' ' A' ' 61' ' ' SER . 0.1 OUTLIER -88.71 -35.52 16.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 112.606 0.595 . . . . 2.28 112.606 -179.069 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.87 -19.86 10.89 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 121.64 -0.314 . . . . 1.21 112.492 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.595 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 57.8 m -71.13 -58.41 3.58 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 120.971 0.415 . . . . 2.18 110.145 177.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.431 ' HD2' H5'' ' P' ' 602' ' ' ' C' . 99.8 mtt180 -67.96 138.1 55.67 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 107.655 -1.239 . . . . 2.89 107.655 167.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 49.5 ttp180 -142.63 126.01 16.65 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.421 -0.585 . . . . 3.59 109.421 -172.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.79 ' HD2' HG22 ' A' ' 69' ' ' VAL . 0.0 OUTLIER 62.51 56.07 2.12 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.476 -0.784 . . . . 1.98 112.194 -175.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.891 HG23 ' HA3' ' A' ' 68' ' ' GLY . 2.2 t -78.82 139.21 57.74 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 108.114 -1.069 . . . . 0.44 108.114 167.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.529 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.32 -59.76 1.1 Allowed 'Trans proline' 0 N--CA 1.48 0.685 0 C-N-CA 123.459 2.773 . . . . 0.44 112.978 -173.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.7 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -66.35 -38.86 94.0 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.407 -0.902 . . . . 0.25 111.245 177.3 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.891 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.68 -34.97 65.41 Favored Glycine 0 N--CA 1.449 -0.458 0 CA-C-N 115.333 -0.433 . . . . 0.3 112.909 -179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.79 HG22 ' HD2' ' A' ' 64' ' ' ARG . 98.8 t -59.04 -42.78 87.38 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-O 121.106 0.479 . . . . 0.74 110.133 176.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.555 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 10.5 t80 -65.59 -37.01 85.42 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.825 -0.625 . . . . 0.26 109.975 174.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.7 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.39 -34.58 70.88 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 108.761 -0.829 . . . . 0.32 108.761 177.744 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 1.114 ' HB2' HD23 ' A' ' 55' ' ' LEU . 65.4 t30 -60.04 -30.61 69.3 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 115.656 -0.702 . . . . 1.08 110.186 177.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.86 HD11 HG23 ' A' ' 46' ' ' THR . 84.9 mt -58.62 -34.26 70.95 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.619 -0.719 . . . . 0.46 112.111 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.813 ' HB3' HG23 ' A' ' 85' ' ' ILE . 7.3 mp -65.73 -20.34 66.24 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.109 0.48 . . . . 1.08 110.795 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.702 ' HD3' ' C5 ' ' P' ' 600' ' ' ' A' . 8.9 mtmm -92.79 -34.35 13.91 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.281 0.562 . . . . 1.93 110.254 174.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 11.0 t30 -87.46 -13.11 44.1 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.154 -0.93 . . . . 2.12 110.877 -173.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.512 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 14.7 t -62.76 130.26 93.64 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.737 0.78 . . . . 0.94 110.751 -177.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.512 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 2.8 Cg_exo -74.86 -39.95 1.11 Allowed 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 123.439 2.76 . . . . 1.0 113.725 -171.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.2 m -112.94 16.15 19.5 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 114.105 1.15 . . . . 1.49 114.105 -167.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.419 HD13 HG21 ' A' ' 34' ' ' ILE . 55.8 mt -112.6 137.69 44.53 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 118.683 0.674 . . . . 1.21 111.437 -177.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 15.4 m -74.04 141.44 45.76 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.523 -0.762 . . . . 1.79 111.042 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -62.15 -27.56 69.04 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.182 -0.917 . . . . 2.89 112.869 -174.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -57.84 -46.72 84.34 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.917 0.389 . . . . 2.06 110.137 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.564 ' O ' HG13 ' A' ' 88' ' ' ILE . 77.9 mm-40 -60.68 -38.86 86.36 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.703 -0.68 . . . . 2.31 109.869 177.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.813 HG23 ' HB3' ' A' ' 74' ' ' LEU . 33.4 mm -60.03 -50.65 79.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.377 -0.829 . . . . 1.41 110.608 -179.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.546 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 18.8 ttpt -60.06 -43.46 95.41 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 115.608 -0.724 . . . . 2.45 110.284 176.022 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -63.72 -34.31 77.58 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.411 -0.813 . . . . 1.7 111.715 -174.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.67 HD13 ' HA ' ' A' ' 30' ' ' VAL . 72.9 mt -70.29 -72.34 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 112.174 0.435 . . . . 0.42 112.174 -177.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.856 ' HB3' HD11 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -106.48 -16.38 14.55 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 113.361 0.874 . . . . 0.75 113.361 -168.589 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.662 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 86.9 t80 -77.47 -24.75 50.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.355 0.598 . . . . 1.13 110.212 -173.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt -82.65 -23.12 8.93 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.561 -0.745 . . . . 0.86 109.721 174.051 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.3 tp10 53.22 -93.65 0.03 OUTLIER 'General case' 0 C--O 1.233 0.207 0 CA-C-N 114.77 -1.105 . . . . 2.67 111.175 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -145.98 22.37 1.4 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.004 0.43 . . . . 4.7 110.27 -179.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -61.09 139.38 58.1 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.566 -0.743 . . . . 3.67 110.777 -177.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . 0.423 ' HE2' ' CE2' ' A' ' 97' ' ' TYR . 26.3 pttm -127.39 -175.8 3.55 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 109.366 -0.605 . . . . 7.97 109.366 177.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -128.58 120.18 26.19 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-O 121.426 0.632 . . . . 7.59 111.632 -174.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.423 ' CE2' ' HE2' ' A' ' 95' ' ' LYS . 34.6 m-85 -84.88 58.69 5.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.807 -0.633 . . . . 8.84 109.723 172.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 60.12 26.81 16.22 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 115.801 -0.636 . . . . 10.06 110.978 -177.282 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 47.3 m-80 66.31 -81.64 0.03 OUTLIER 'General case' 0 C--O 1.234 0.241 0 CA-C-N 114.967 -1.015 . . . . 12.32 112.188 176.012 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 14.0 mptt -115.08 -55.63 2.45 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.209 0.528 . . . . 14.02 110.701 -177.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.432 ' HB3' ' HE2' ' A' ' 101' ' ' LYS . 35.4 ttpt -87.07 78.77 8.86 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.92 -0.582 . . . . 15.92 110.902 -175.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -81.64 93.9 6.84 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.807 -0.633 . . . . 17.13 109.992 175.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -75.09 91.17 2.54 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-O 121.167 0.508 . . . . 18.06 111.119 -177.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.927 -1.035 . . . . 19.51 109.717 177.537 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' P' P ' 600' ' ' ' A' . . . . . 0.842 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.515 -0.933 0 C4'-C3'-C2' 99.678 -3.022 OUTLIER-DELTA 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 601' ' ' ' U' . . . . . 0.796 " O3'" ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.51 -1.36 1 C4'-C3'-C2' 96.369 -6.331 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' P' P ' 602' ' ' ' C' . . . . . 0.658 ' OP1' ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 P-O3'-C3' 120.687 0.823 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.882 0 C4'-C3'-C2' 103.809 1.109 . 0.049 1t . 7.45 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.685 0 N-CA-C 112.023 -0.431 . . . . 9.19 112.023 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 56.58 43.58 25.42 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 122.942 0.497 . . . . 7.69 111.432 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 15.9 tpt -132.15 -64.07 0.79 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.461 -0.336 . . . . 7.18 110.829 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -162.42 52.89 0.21 Allowed 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.988 0.423 . . . . 4.5 110.425 -176.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -71.55 -46.51 59.29 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.118 0.485 . . . . 4.1 110.044 -179.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.739 ' HB2' HD22 ' A' ' 36' ' ' ASN . 3.6 m-20 -120.86 59.41 0.93 Allowed 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.736 -0.665 . . . . 1.79 109.693 -178.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.437 ' O ' HG23 ' A' ' 11' ' ' VAL . 6.2 m -58.33 124.34 19.16 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.66 -0.496 . . . . 1.33 109.66 176.116 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.474 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.9 mt-30 -57.21 -32.28 66.33 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.883 -0.599 . . . . 1.88 112.155 -169.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -69.92 -42.1 73.75 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.065 0.46 . . . . 2.17 110.291 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -71.03 -38.87 72.58 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.815 -0.63 . . . . 2.55 110.277 176.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.655 ' O ' HG12 ' A' ' 15' ' ' ILE . 69.3 t -58.12 -51.53 69.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.231 0 CA-C-N 115.942 -0.572 . . . . 0.39 110.981 178.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.95 -37.52 63.99 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.088 0.47 . . . . 0.35 111.155 -179.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -68.69 -41.23 79.48 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.643 -0.708 . . . . 0.86 110.191 179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 41.1 mm-40 -64.77 -47.41 78.24 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.572 -0.74 . . . . 2.05 111.907 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.756 HG23 HD21 ' A' ' 43' ' ' LEU . 3.4 mm -60.38 -49.87 82.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-O 120.887 0.375 . . . . 0.33 110.326 -175.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.6 ' HB3' HG21 ' A' ' 27' ' ' ILE . 23.1 p -61.16 -32.66 72.38 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.95 -0.568 . . . . 0.32 111.314 -176.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 85.9 t80 -70.54 -44.98 66.38 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 116.162 -0.472 . . . . 0.59 110.649 179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.41 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 77.8 mtt180 -75.25 -31.36 60.78 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.041 -0.527 . . . . 2.83 111.693 -173.199 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.633 HD11 ' HB2' ' A' ' 70' ' ' PHE . 3.9 mm? -82.54 -15.56 51.86 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.623 -0.431 . . . . 0.99 111.173 174.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 50.6 mt-30 55.18 29.91 13.54 Favored 'General case' 0 CA--C 1.52 -0.195 0 N-CA-C 108.395 -0.965 . . . . 1.6 108.395 -170.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.492 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 24.7 tt0 -71.73 132.96 84.76 Favored Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 113.904 -1.498 . . . . 1.31 112.271 -168.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.58 ' HD2' ' O4 ' ' P' ' 601' ' ' ' U' . 38.8 Cg_endo -63.47 -49.01 4.94 Favored 'Trans proline' 0 C--N 1.351 0.679 0 C-N-CA 124.737 3.625 . . . . 0.41 113.625 178.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.604 ' HD2' ' HB3' ' A' ' 26' ' ' LEU . 0.0 OUTLIER -89.99 69.81 7.41 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 122.006 0.908 . . . . 1.41 110.708 -175.314 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.505 ' O ' HG22 ' A' ' 27' ' ' ILE . 77.7 mttt -66.88 -23.82 66.05 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.616 -1.175 . . . . 1.75 112.513 -170.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -65.37 -37.28 86.53 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.364 0.602 . . . . 2.14 110.021 175.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.604 ' HB3' ' HD2' ' A' ' 23' ' ' LYS . 1.4 tm? -72.93 -40.98 64.99 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.348 -0.842 . . . . 1.33 110.479 -178.063 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.6 HG21 ' HB3' ' A' ' 16' ' ' SER . 3.8 tp -63.09 -31.15 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.287 0 CA-C-O 121.079 0.466 . . . . 0.44 109.919 179.642 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.656 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.48 -34.09 65.17 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-N 115.913 -0.585 . . . . 0.21 110.562 174.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 10.9 ttm180 -62.3 -41.38 98.47 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 116.211 -0.45 . . . . 1.48 110.923 178.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.609 ' O ' HG12 ' A' ' 34' ' ' ILE . 19.9 t -54.02 -44.59 62.9 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.23 0 N-CA-C 109.001 -0.74 . . . . 1.1 109.001 177.476 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.656 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 91.8 t -53.2 -49.04 53.5 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 114.34 -1.3 . . . . 0.22 111.038 175.389 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.418 HH11 ' HD3' ' A' ' 32' ' ' ARG . 49.4 mtt180 -60.55 -47.48 86.01 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.586 -0.734 . . . . 3.75 110.862 -178.583 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 41.7 mm -73.94 -52.24 21.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 115.701 -0.681 . . . . 0.8 112.329 -172.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.609 HG12 ' O ' ' A' ' 30' ' ' VAL . 21.4 pt -84.94 -28.86 6.58 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 C-N-CA 120.628 -0.429 . . . . 0.4 111.944 -172.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.21 155.98 9.94 Favored Glycine 0 N--CA 1.446 -0.647 0 C-N-CA 120.4 -0.905 . . . . 0.26 112.263 -179.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.739 HD22 ' HB2' ' A' ' 6' ' ' ASP . 5.3 p-10 -59.51 -49.42 77.84 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.778 0.288 . . . . 0.91 111.778 -175.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 45.2 pttt -71.62 -33.67 69.16 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.811 0.339 . . . . 3.19 111.05 -175.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.473 ' HB2' HG13 ' A' ' 34' ' ' ILE . 0.2 OUTLIER -64.26 -31.68 72.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.038 -0.528 . . . . 2.45 110.832 -178.222 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.487 ' O ' ' HG ' ' A' ' 43' ' ' LEU . . . -64.15 -44.73 91.25 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.28 -0.418 . . . . 0.29 110.454 176.613 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 1.9 mp -66.05 -39.64 85.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-N 116.124 -0.489 . . . . 1.13 110.317 177.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.453 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 51.4 mt-10 -58.41 -42.95 88.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.127 -0.488 . . . . 2.1 110.822 177.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.839 ' HB3' HD13 ' A' ' 73' ' ' LEU . 53.1 mt -63.27 -37.87 88.95 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.512 -0.313 . . . . 0.29 110.847 177.093 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.756 HD21 HG23 ' A' ' 15' ' ' ILE . 85.6 mt -60.99 -30.78 70.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.073 0.463 . . . . 1.36 111.123 178.312 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 15.2 tmm? -73.99 -39.17 63.85 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.352 -0.611 . . . . 2.2 109.352 174.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 31.0 mt-10 -70.45 -25.49 63.21 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.658 -0.701 . . . . 1.83 112.464 -177.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.655 HG22 HD11 ' A' ' 73' ' ' LEU . 71.2 p -52.04 -41.5 62.35 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 120.921 0.391 . . . . 1.03 110.717 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.56 -35.07 75.16 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.684 -0.689 . . . . 0.88 111.418 -178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 mm-40 -68.85 -33.93 74.62 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.984 0.421 . . . . 2.51 110.498 -179.725 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 81.5 t -76.96 -35.81 24.17 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-O 120.967 0.413 . . . . 0.76 110.323 174.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.567 ' HA ' HH21 ' A' ' 64' ' ' ARG . 6.7 mm-40 -61.05 -43.56 98.71 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.042 -0.526 . . . . 1.96 111.361 177.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.0 pt20 -69.81 -26.27 64.17 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.813 0.339 . . . . 2.25 110.782 179.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -83.17 -25.07 32.19 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.082 0.468 . . . . 2.34 111.04 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.501 ' HA2' ' NH1' ' A' ' 64' ' ' ARG . . . 72.95 44.4 37.09 Favored Glycine 0 N--CA 1.445 -0.706 0 CA-C-N 115.521 -0.763 . . . . 1.33 111.804 -178.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -114.43 126.01 7.09 Favored Glycine 0 N--CA 1.448 -0.545 0 C-N-CA 120.248 -0.977 . . . . 0.89 114.865 -170.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.75 HD13 ' HB2' ' A' ' 72' ' ' ASN . 38.6 tp -176.87 127.72 0.17 Allowed 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 121.23 0.538 . . . . 1.38 111.72 163.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -119.27 112.69 19.79 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 107.971 -1.122 . . . . 2.87 107.971 163.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.871 HG22 " H4'" ' P' ' 600' ' ' ' A' . 1.1 pt -86.96 -165.36 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.805 -0.634 . . . . 0.68 111.516 -175.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.751 ' HG3' " C3'" ' P' ' 601' ' ' ' U' . 3.9 mtt -42.12 -46.33 4.28 Favored 'General case' 0 N--CA 1.47 0.541 0 O-C-N 123.876 0.735 . . . . 0.91 111.806 -173.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -120.82 -33.27 3.81 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.101 -0.499 . . . . 2.28 111.193 -174.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.456 ' O ' ' HB3' ' A' ' 63' ' ' ARG . . . 106.16 -12.07 44.41 Favored Glycine 0 CA--C 1.526 0.727 0 C-N-CA 120.285 -0.96 . . . . 1.21 115.257 172.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 65.8 p -65.28 -55.88 15.85 Favored 'General case' 0 N--CA 1.467 0.425 0 CA-C-N 118.46 1.13 . . . . 2.18 111.17 179.572 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.576 ' C ' HD11 ' A' ' 57' ' ' ILE . 60.4 mtp180 -81.71 26.9 0.47 Allowed 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.528 -0.76 . . . . 2.89 110.368 179.331 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.589 ' HA ' HG12 ' A' ' 57' ' ' ILE . 25.8 ptt180 -46.53 133.39 10.15 Favored 'General case' 0 C--O 1.233 0.21 0 O-C-N 123.916 0.76 . . . . 3.59 112.434 -169.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.892 ' HD2' HG22 ' A' ' 69' ' ' VAL . 4.8 tpt180 73.14 80.67 0.13 Allowed 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.002 -0.999 . . . . 1.98 111.817 176.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.873 HG23 ' HA3' ' A' ' 68' ' ' GLY . 0.3 OUTLIER -105.36 147.72 35.08 Favored Pre-proline 0 C--N 1.32 -0.69 0 CA-C-N 114.885 -1.052 . . . . 0.44 108.279 172.127 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.481 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.9 Cg_endo -45.76 -59.69 1.1 Allowed 'Trans proline' 0 N--CA 1.483 0.86 0 C-N-CA 123.536 2.824 . . . . 0.44 112.998 -176.033 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.689 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -63.31 -40.74 99.31 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.085 -1.055 . . . . 0.25 110.85 175.669 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.873 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.46 -29.56 57.43 Favored Glycine 0 CA--C 1.52 0.379 0 CA-C-N 115.139 -0.53 . . . . 0.3 113.289 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.892 HG22 ' HD2' ' A' ' 64' ' ' ARG . 41.5 t -67.75 -33.59 62.66 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.118 0.485 . . . . 0.74 109.997 179.393 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.633 ' HB2' HD11 ' A' ' 19' ' ' LEU . 12.1 t80 -65.23 -35.74 81.98 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.305 -0.628 . . . . 0.26 109.305 171.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.689 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.22 -36.26 72.89 Favored 'General case' 0 N--CA 1.464 0.256 0 N-CA-C 108.462 -0.94 . . . . 0.32 108.462 178.532 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.75 ' HB2' HD13 ' A' ' 55' ' ' LEU . 44.0 t-20 -56.58 -35.21 67.95 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.651 -0.704 . . . . 1.08 109.9 178.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.839 HD13 ' HB3' ' A' ' 42' ' ' LEU . 95.6 mt -58.13 -37.01 73.79 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.153 -0.931 . . . . 0.46 112.178 -176.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.876 ' HB3' HG23 ' A' ' 85' ' ' ILE . 6.4 mp -65.83 -28.87 69.31 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.162 0.506 . . . . 1.08 110.479 -178.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.551 ' HD2' ' C2 ' ' P' ' 600' ' ' ' A' . 0.0 OUTLIER -80.92 -42.5 21.26 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.121 0.486 . . . . 1.93 110.648 176.715 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -100.28 26.12 6.88 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.728 -0.669 . . . . 2.12 111.363 -173.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.501 ' HA ' ' HD3' ' A' ' 78' ' ' PRO . 5.4 t -80.95 124.73 81.19 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 121.447 0.642 . . . . 0.94 110.517 178.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.501 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.4 Cg_exo -75.78 -9.97 19.83 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.29 2.66 . . . . 1.0 113.01 -176.62 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 10.5 m -111.51 -20.71 12.1 Favored 'General case' 0 C--N 1.329 -0.326 0 N-CA-C 113.208 0.818 . . . . 1.49 113.208 -170.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.423 ' HB ' HG21 ' A' ' 77' ' ' THR . 17.7 mt -111.4 139.87 33.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 CA-C-O 120.774 0.321 . . . . 1.21 111.313 -171.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 10.8 t -76.17 142.0 41.69 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.31 0.576 . . . . 1.79 110.044 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.402 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 1.8 mp0 -57.23 -37.59 72.5 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 114.691 -1.141 . . . . 2.89 113.116 -168.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.6 tp10 -62.54 -37.28 85.5 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.074 0.464 . . . . 2.06 110.764 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 35.9 tp60 -68.37 -23.64 64.7 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.587 0.708 . . . . 2.31 110.073 -177.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.876 HG23 ' HB3' ' A' ' 74' ' ' LEU . 46.5 mm -70.73 -36.96 67.16 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 114.839 -1.073 . . . . 1.41 111.169 -178.108 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.555 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 37.4 ttmt -56.83 -36.15 69.63 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.485 -0.78 . . . . 2.45 111.896 -177.249 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 7.1 t70 -71.52 -33.29 69.07 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.359 -0.382 . . . . 1.7 111.629 -173.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.7 mt -70.95 -72.21 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 113.167 0.803 . . . . 0.42 113.167 -170.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.728 ' H ' ' HD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -104.3 -19.19 14.18 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 112.695 0.628 . . . . 0.75 112.695 -166.854 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.555 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 60.5 t80 -74.83 -23.86 58.52 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 121.311 0.577 . . . . 1.13 110.945 -173.724 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 47.1 mt -88.99 -8.12 10.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 CA-C-N 115.605 -0.725 . . . . 0.86 111.022 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 55.47 -95.31 0.05 OUTLIER 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 121.399 0.618 . . . . 2.67 111.677 -176.665 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -139.46 16.54 2.56 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-N 115.484 -0.78 . . . . 4.7 109.817 -178.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -73.9 75.0 1.65 Allowed 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.499 0.666 . . . . 3.67 111.266 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 43.6 pttt -128.04 116.19 19.64 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.318 -0.856 . . . . 7.97 108.81 173.119 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 61.5 mm-40 -98.73 -48.58 4.9 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.079 -0.51 . . . . 7.59 111.312 -172.56 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 96.0 m-85 -98.11 62.84 1.56 Allowed 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.082 0.468 . . . . 8.84 112.241 -170.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -108.47 125.35 51.69 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.98 -1.119 . . . . 10.06 107.98 164.464 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 95.5 m-20 -78.06 80.17 4.5 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.939 0.4 . . . . 12.32 111.683 -173.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -83.12 55.09 2.99 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 122.026 0.917 . . . . 14.02 108.742 172.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 56.2 pttt -158.71 144.41 16.61 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 114.725 -1.125 . . . . 15.92 108.832 -177.39 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 59.65 29.58 19.15 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 121.289 0.566 . . . . 17.13 110.284 -173.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -157.36 -165.18 1.74 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.302 -0.863 . . . . 18.06 109.811 -176.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 . . . . . 0 C--O 1.246 0.915 0 CA-C-O 118.991 -0.528 . . . . 19.51 110.934 -179.982 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' P' P ' 600' ' ' ' A' . . . . . 0.871 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.514 -0.99 0 C3'-C2'-C1' 98.232 -3.631 OUTLIER-DELTA 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 601' ' ' ' U' . . . . . 0.751 " C3'" ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.51 -1.385 1 C4'-C3'-C2' 96.042 -6.658 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' P' P ' 602' ' ' ' C' . . . . . 0.565 ' OP1' ' HB ' ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.424 -0.986 0 C4'-C3'-C2' 104.67 1.97 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.933 0 C4'-C3'-C2' 105.726 3.026 . 0.0 OUTLIER gamma 7.45 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.761 0 N-CA-C 111.555 -0.618 . . . . 9.19 111.555 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -92.94 -49.58 5.97 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.487 0.184 . . . . 7.69 111.198 -176.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.3 ptt? -159.59 164.22 34.39 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.105 0.479 . . . . 7.18 110.85 -175.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -130.15 103.51 6.77 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.638 -0.71 . . . . 4.5 109.877 176.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.6 mt-10 -84.54 85.5 7.41 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-O 121.458 0.647 . . . . 4.1 109.568 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.53 ' HB2' ' CG2' ' A' ' 11' ' ' VAL . 12.0 p-10 -75.99 105.59 7.11 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.008 -0.996 . . . . 1.79 111.67 -172.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.465 ' O ' HG23 ' A' ' 11' ' ' VAL . 17.5 m -79.86 127.87 32.75 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.443 -0.799 . . . . 1.33 109.363 175.279 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.714 ' HA ' ' HB3' ' A' ' 36' ' ' ASN . 3.4 pt20 -51.91 -43.65 63.49 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 113.731 1.011 . . . . 1.88 113.731 -167.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -71.36 -34.95 70.93 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.115 0.483 . . . . 2.17 110.268 -178.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 28.7 tptp -65.67 -42.19 91.61 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.681 -0.691 . . . . 2.55 109.666 176.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.568 ' O ' HG12 ' A' ' 15' ' ' ILE . 60.2 t -62.15 -42.85 96.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 115.602 -0.726 . . . . 0.39 110.431 176.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.73 -41.7 77.93 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.18 -0.464 . . . . 0.35 111.36 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -67.27 -31.11 71.22 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.318 -0.401 . . . . 0.86 110.418 178.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -65.64 -50.54 64.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.463 -0.335 . . . . 2.05 110.779 175.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.861 HG23 HD21 ' A' ' 43' ' ' LEU . 2.0 mm -60.57 -49.48 84.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 CA-C-O 120.768 0.318 . . . . 0.33 110.555 -176.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.532 ' HB2' ' HD2' ' A' ' 24' ' ' LYS . 18.9 p -57.96 -43.04 86.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 115.864 -0.607 . . . . 0.32 111.454 -176.052 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -63.72 -41.52 98.06 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.666 -0.697 . . . . 0.59 111.141 178.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -77.42 -36.91 52.8 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.256 -0.429 . . . . 2.83 111.905 -174.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.86 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.5 mm? -83.04 -5.61 59.17 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 111.973 0.36 . . . . 0.99 111.973 -178.167 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 49.8 mt-30 55.82 39.97 30.68 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 108.762 -0.829 . . . . 1.6 108.762 -172.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.8 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -64.12 120.34 63.5 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 114.31 -1.313 . . . . 1.31 111.753 -171.065 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.429 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 71.6 Cg_endo -70.08 -34.96 12.55 Favored 'Trans proline' 0 N--CA 1.474 0.351 0 C-N-CA 123.976 3.117 . . . . 0.41 113.478 177.088 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.675 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 35.5 pttt -120.38 66.24 0.83 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 121.319 0.58 . . . . 1.41 109.499 -173.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.532 ' HD2' ' HB2' ' A' ' 16' ' ' SER . 40.1 mtmt -61.06 -12.41 11.78 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 114.035 1.124 . . . . 1.75 114.035 -163.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 38.1 t70 -69.23 -28.66 66.54 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 120.339 -0.544 . . . . 2.14 109.581 173.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.855 HD21 ' HA ' ' A' ' 89' ' ' PHE . 1.8 tm? -71.84 -52.05 19.34 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.46 -0.791 . . . . 1.33 109.926 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.8 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 10.1 tp -62.22 -34.58 64.64 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 CA-C-N 116.151 -0.477 . . . . 0.44 110.525 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.71 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -70.88 -32.24 69.16 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-O 121.548 0.69 . . . . 0.21 110.477 174.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.43 ' O ' HG12 ' A' ' 33' ' ' ILE . 36.4 ttm180 -66.91 -41.6 86.85 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.548 -0.751 . . . . 1.48 111.587 -179.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.729 HG21 ' HE1' ' A' ' 70' ' ' PHE . 16.3 t -53.4 -44.72 55.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.469 0 N-CA-C 108.66 -0.867 . . . . 1.1 108.66 176.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.71 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.1 t -52.51 -53.42 20.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 CA-C-N 113.63 -1.623 . . . . 0.22 111.201 175.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -66.24 -35.51 80.6 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.56 -0.745 . . . . 3.75 112.06 -174.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.636 HG13 HG12 ' A' ' 88' ' ' ILE . 50.5 mm -75.03 -51.82 20.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 112.294 0.479 . . . . 0.8 112.294 -177.15 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.786 HG21 HD13 ' A' ' 80' ' ' ILE . 33.7 pt -90.18 -25.64 5.47 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-O 120.89 0.376 . . . . 0.4 111.854 -175.126 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.1 139.56 6.24 Favored Glycine 0 N--CA 1.444 -0.798 0 C-N-CA 120.722 -0.751 . . . . 0.26 111.356 -175.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.714 ' HB3' ' HA ' ' A' ' 8' ' ' GLN . 0.9 OUTLIER -55.55 -37.95 68.65 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 120.834 0.349 . . . . 0.91 111.86 -179.195 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.47 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 34.0 ttmt -71.58 -33.87 69.44 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.145 0.498 . . . . 3.19 110.262 -178.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -69.86 -31.12 68.78 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.934 -0.576 . . . . 2.45 110.714 176.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -62.79 -38.66 91.54 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.13 0.49 . . . . 0.29 110.222 175.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.26 -41.65 93.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 115.912 -0.585 . . . . 1.13 110.441 176.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -55.73 -47.0 77.66 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-N 115.779 -0.646 . . . . 2.1 110.448 175.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.753 ' HB3' HD13 ' A' ' 73' ' ' LEU . 48.5 mt -60.58 -38.62 85.22 Favored 'General case' 0 N--CA 1.451 -0.376 0 CA-C-N 115.619 -0.719 . . . . 0.29 111.26 -179.398 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.861 HD21 HG23 ' A' ' 15' ' ' ILE . 14.4 mt -60.05 -32.48 70.96 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-O 120.877 0.37 . . . . 1.36 111.498 -178.18 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.8 mtp -74.59 -37.01 63.02 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.111 0.481 . . . . 2.2 109.881 175.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.418 ' O ' HG23 ' A' ' 49' ' ' VAL . 52.3 mt-10 -70.55 -27.45 64.15 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.444 -0.798 . . . . 1.83 111.623 179.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.534 HG23 HD11 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -62.87 -39.12 93.46 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.767 0.317 . . . . 1.03 110.833 -177.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -58.59 -44.15 89.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.035 -0.53 . . . . 0.88 111.785 -176.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.932 ' HA ' ' HG2' ' A' ' 51' ' ' GLN . 6.6 pt-20 -75.69 -30.27 59.27 Favored 'General case' 0 C--N 1.325 -0.458 0 C-N-CA 120.671 -0.412 . . . . 2.51 111.422 -179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 45' ' ' GLU . 84.5 t -65.23 -35.62 75.81 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 CA-C-O 121.496 0.665 . . . . 0.76 109.421 173.48 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.428 ' CG ' HG11 ' A' ' 69' ' ' VAL . 40.6 mt-10 -69.29 -47.02 65.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.553 -0.748 . . . . 1.96 111.121 175.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.932 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 17.0 pt20 -65.12 -27.04 68.47 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.114 0.483 . . . . 2.25 110.728 -177.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -94.27 -4.19 49.27 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.047 -0.524 . . . . 2.34 111.454 -177.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.23 50.08 41.76 Favored Glycine 0 C--N 1.331 0.28 0 CA-C-N 115.919 -0.582 . . . . 1.33 113.386 176.302 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -108.93 111.96 3.37 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.231 -0.985 . . . . 0.89 113.975 -177.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.763 HD21 HG23 ' A' ' 57' ' ' ILE . 34.6 tp -177.34 126.95 0.15 Allowed 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.576 0.584 . . . . 1.38 112.576 167.178 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -125.65 93.54 3.87 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.592 -0.731 . . . . 2.87 109.081 164.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.91 HG22 " H4'" ' P' ' 600' ' ' ' A' . 3.8 pt -72.15 -170.03 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.455 0 N-CA-C 112.451 0.537 . . . . 0.68 112.451 -176.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.679 ' HG3' " C3'" ' P' ' 601' ' ' ' U' . 2.7 mtt -42.01 -47.63 4.46 Favored 'General case' 0 N--CA 1.471 0.617 0 O-C-N 123.88 0.738 . . . . 0.91 111.468 -174.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.52 ' ND2' H5'' ' P' ' 602' ' ' ' C' . 6.1 p30 -103.89 -35.81 8.02 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 115.797 -0.638 . . . . 2.28 111.746 -172.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 97.13 -19.52 54.47 Favored Glycine 0 CA--C 1.524 0.599 0 C-N-CA 121.069 -0.586 . . . . 1.21 113.701 176.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.465 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 66.1 m -72.61 -45.5 58.76 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 117.183 0.492 . . . . 2.18 111.251 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.746 ' HB3' HD11 ' A' ' 57' ' ' ILE . 7.4 ttm180 -80.47 49.37 1.14 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 121.91 0.862 . . . . 2.89 109.091 176.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 44.4 ttp180 -54.4 123.17 12.15 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 114.651 -1.159 . . . . 3.59 111.543 -173.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.742 ' HD2' HG22 ' A' ' 69' ' ' VAL . 1.2 mmm180 72.27 56.81 0.15 Allowed 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 113.452 0.908 . . . . 1.98 113.452 173.121 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.714 HG23 ' HA3' ' A' ' 68' ' ' GLY . 3.9 t -77.74 140.65 63.51 Favored Pre-proline 0 C--N 1.323 -0.579 0 CA-C-N 115.657 -0.701 . . . . 0.44 109.159 169.228 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.4 Cg_endo -48.18 -59.45 1.24 Allowed 'Trans proline' 0 N--CA 1.485 1.011 0 C-N-CA 124.047 3.165 . . . . 0.44 113.43 -173.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.86 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -62.26 -39.86 98.26 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 110.868 -0.893 . . . . 0.25 110.868 177.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.714 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -58.94 -31.67 68.85 Favored Glycine 0 N--CA 1.447 -0.628 0 CA-C-N 115.109 -0.546 . . . . 0.3 113.247 -179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.742 HG22 ' HD2' ' A' ' 64' ' ' ARG . 43.2 t -62.76 -36.39 75.17 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.311 0 CA-C-O 121.181 0.515 . . . . 0.74 110.239 179.204 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.729 ' HE1' HG21 ' A' ' 30' ' ' VAL . 13.4 t80 -65.48 -36.37 83.67 Favored 'General case' 0 N--CA 1.445 -0.721 0 CA-C-N 115.955 -0.566 . . . . 0.26 109.634 173.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.631 HD12 " O5'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -59.4 -34.64 72.7 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.605 -0.887 . . . . 0.32 108.605 178.387 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.676 ' HB2' HD13 ' A' ' 55' ' ' LEU . 62.1 t30 -61.27 -30.41 70.45 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 115.266 -0.879 . . . . 1.08 110.489 178.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.753 HD13 ' HB3' ' A' ' 42' ' ' LEU . 71.1 mt -57.99 -36.09 72.14 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.296 -0.865 . . . . 0.46 111.885 -177.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.943 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.2 mp -60.83 -21.9 63.64 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-O 121.105 0.478 . . . . 1.08 110.859 -178.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.501 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -93.05 -38.45 11.62 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 121.989 -0.445 . . . . 1.93 111.576 179.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.63 ' OD1' ' HA ' ' A' ' 73' ' ' LEU . 2.9 p-10 -93.37 -8.14 42.73 Favored 'General case' 0 N--CA 1.465 0.291 0 C-N-CA 120.914 -0.315 . . . . 2.12 111.648 -174.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.55 HG21 ' HB ' ' A' ' 80' ' ' ILE . 7.9 t -56.22 127.65 70.98 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-O 121.436 0.636 . . . . 0.94 111.333 -177.447 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.3 Cg_exo -76.07 -14.82 18.76 Favored 'Trans proline' 0 N--CA 1.457 -0.623 0 C-N-CA 123.551 2.834 . . . . 1.0 113.055 -175.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 4.6 m -112.31 -17.27 12.78 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.451 0.908 . . . . 1.49 113.451 -169.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.786 HD13 HG21 ' A' ' 34' ' ' ILE . 36.5 mt -103.84 139.98 23.26 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-O 121.03 0.443 . . . . 1.21 112.096 -169.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.425 ' O ' HG12 ' A' ' 85' ' ' ILE . 46.9 m -84.33 156.57 21.84 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 115.805 -0.634 . . . . 1.79 111.678 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.458 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 34.3 tt0 -65.92 -41.31 91.55 Favored 'General case' 0 CA--C 1.532 0.264 0 N-CA-C 114.248 1.203 . . . . 2.89 114.248 -164.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -62.86 -47.03 85.13 Favored 'General case' 0 N--CA 1.466 0.331 0 C-N-CA 120.55 -0.46 . . . . 2.06 111.63 -174.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.571 ' O ' HG13 ' A' ' 88' ' ' ILE . 46.9 mt-30 -56.83 -33.56 66.88 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.259 -0.428 . . . . 2.31 110.528 179.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.943 HG23 ' HB3' ' A' ' 74' ' ' LEU . 36.3 mm -60.12 -50.74 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 115.796 -0.638 . . . . 1.41 110.652 177.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.536 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.8 ttpt -59.25 -39.1 81.76 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.525 -0.761 . . . . 2.45 110.753 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 56.7 m-20 -65.84 -33.07 74.99 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.437 -0.347 . . . . 1.7 111.652 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.709 HG21 HG22 ' A' ' 30' ' ' VAL . 75.2 mt -70.44 -71.44 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 N-CA-C 112.457 0.54 . . . . 0.42 112.457 -174.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.855 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -104.8 -10.78 17.16 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.32 0.859 . . . . 0.75 113.32 -165.836 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.536 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.9 t80 -89.46 -22.51 22.46 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.167 0.508 . . . . 1.13 110.947 -173.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.5 mt -88.78 -29.04 5.24 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.092 -0.504 . . . . 0.86 110.852 179.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 60.58 -83.61 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 115.501 -0.772 . . . . 2.67 111.124 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.489 HD22 ' N ' ' A' ' 93' ' ' ASN . 0.1 OUTLIER -161.28 20.1 0.12 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.968 0.413 . . . . 4.7 110.331 178.752 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -84.65 59.59 5.6 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.144 0.497 . . . . 3.67 111.358 -175.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 21.8 mmtp -146.35 127.21 14.43 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.813 -0.63 . . . . 7.97 110.463 177.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 13.4 mm-40 72.72 -67.35 0.27 Allowed 'General case' 0 N--CA 1.465 0.31 0 O-C-N 123.918 0.761 . . . . 7.59 112.785 171.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -96.76 81.7 3.19 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.439 0.638 . . . . 8.84 111.865 -170.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.4 ' H ' ' HG3' ' A' ' 98' ' ' GLU . 0.0 OUTLIER -102.21 172.14 7.07 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.207 -0.906 . . . . 10.06 109.626 174.469 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -119.23 68.76 0.81 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.874 0.368 . . . . 12.32 110.947 -175.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.483 ' NZ ' ' HB2' ' A' ' 100' ' ' LYS . 4.7 ttmp? -108.85 90.12 3.2 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 120.906 0.384 . . . . 14.02 110.296 176.17 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 1.7 mptm? -82.23 -19.47 39.64 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.019 0.438 . . . . 15.92 110.733 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -83.24 6.29 20.04 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.072 -0.513 . . . . 17.13 111.048 -179.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -74.2 87.56 1.95 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.095 -0.502 . . . . 18.06 110.703 178.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 104' ' ' ARG . 15.3 tpt180 . . . . . 0 C--O 1.246 0.921 0 CA-C-O 118.259 -0.877 . . . . 19.51 109.614 177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' P' P ' 600' ' ' ' A' . . . . . 0.91 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.515 -0.909 0 C3'-C2'-C1' 99.057 -2.714 OUTLIER-DELTA 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 601' ' ' ' U' . . . . . 0.679 " C3'" ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.51 -1.359 1 C4'-C3'-C2' 96.136 -6.564 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' P' P ' 602' ' ' ' C' . . . . . 0.52 H5'' ' ND2' ' A' ' 59' ' ' ASN . . . . . . . . 0 O5'--C5' 1.426 -0.895 0 P-O3'-C3' 122.356 2.214 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.851 0 C3'-C2'-C1' 99.994 -1.673 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.729 0 N-CA-C 111.785 -0.526 . . . . 9.19 111.785 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.27 77.13 1.93 Allowed 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.836 0.35 . . . . 7.69 110.778 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 48.8 ttm -107.58 -52.63 2.74 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.841 0.353 . . . . 7.18 110.824 -179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.33 32.81 4.81 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.244 -0.435 . . . . 4.5 111.074 -177.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -95.8 165.16 12.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.381 -0.372 . . . . 4.1 110.21 178.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -109.31 68.59 0.68 Allowed 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 121.188 0.518 . . . . 1.79 109.944 179.138 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.4 m -56.03 131.84 48.48 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.463 -0.79 . . . . 1.33 109.427 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.574 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 96.7 mt-30 -58.44 -33.31 69.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.031 -0.531 . . . . 1.88 112.249 -173.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.15 -40.23 86.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 121.133 0.492 . . . . 2.17 110.42 174.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.568 ' O ' ' HG2' ' A' ' 14' ' ' GLU . 62.5 tttm -70.24 -42.37 72.3 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.759 -0.655 . . . . 2.55 110.262 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.664 ' O ' HG12 ' A' ' 15' ' ' ILE . 91.1 t -59.26 -42.61 87.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.118 -0.492 . . . . 0.39 110.598 177.381 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.68 -41.42 73.7 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.038 0.447 . . . . 0.35 110.57 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -67.35 -42.12 84.01 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.809 -0.632 . . . . 0.86 110.426 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.568 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 71.6 mm-40 -56.86 -51.03 70.65 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.108 -0.496 . . . . 2.05 110.74 179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.664 HG12 ' O ' ' A' ' 11' ' ' VAL . 4.6 mm -63.47 -51.8 66.03 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 C-N-CA 120.709 -0.396 . . . . 0.33 110.318 -177.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.679 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 31.4 p -64.03 -41.59 97.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.445 -0.343 . . . . 0.32 111.759 -172.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -62.54 -44.62 95.9 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.066 0.46 . . . . 0.59 110.646 178.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 40.2 mtt180 -78.73 -31.16 46.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.202 -0.454 . . . . 2.83 111.833 -175.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 1.07 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.3 mm? -77.56 -15.73 59.08 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 111.926 0.343 . . . . 0.99 111.926 177.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 57.15 41.22 27.48 Favored 'General case' 0 CA--C 1.521 -0.161 0 N-CA-C 107.65 -1.241 . . . . 1.6 107.65 -166.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.679 ' HB3' ' HA ' ' A' ' 16' ' ' SER . 7.2 tp10 -81.18 115.7 57.95 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-N 113.243 -1.799 . . . . 1.31 110.968 -170.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.444 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 42.2 Cg_endo -61.98 -47.88 9.66 Favored 'Trans proline' 0 N--CA 1.477 0.535 0 C-N-CA 124.416 3.411 . . . . 0.41 113.521 177.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.653 ' HE2' ' C5 ' ' P' ' 601' ' ' ' U' . 45.1 pttt -92.59 72.52 5.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.058 0.932 . . . . 1.41 109.649 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.665 ' HA ' HG22 ' A' ' 27' ' ' ILE . 65.5 mttt -65.23 -17.66 64.67 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.428 -1.26 . . . . 1.75 111.441 -173.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -75.34 -39.06 59.78 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.418 -0.355 . . . . 2.14 110.524 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.588 ' HG ' ' OE2' ' A' ' 92' ' ' GLU . 1.8 tm? -73.43 -43.61 60.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.003 0.43 . . . . 1.33 109.966 -179.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.672 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 10.6 tp -64.08 -26.92 41.63 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-N 115.969 -0.56 . . . . 0.44 109.756 178.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.687 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.22 -33.31 65.27 Favored 'General case' 0 CA--C 1.523 -0.073 0 CA-C-N 116.267 -0.424 . . . . 0.21 110.934 172.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.637 ' HG2' HG23 ' A' ' 88' ' ' ILE . 6.3 ttm180 -59.35 -45.74 90.53 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 111.718 0.266 . . . . 1.48 111.718 179.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.66 ' O ' HG12 ' A' ' 34' ' ' ILE . 9.5 p -57.55 -36.71 54.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 N-CA-C 109.594 -0.521 . . . . 1.1 109.594 -179.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.687 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 76.8 t -54.87 -50.51 61.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 115.112 -0.949 . . . . 0.22 110.779 173.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.3 mpt_? -63.49 -43.19 97.99 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.398 -0.819 . . . . 3.75 111.41 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.843 HD12 HG12 ' A' ' 88' ' ' ILE . 17.2 mt -74.96 -51.89 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 N-CA-C 113.02 0.748 . . . . 0.8 113.02 -172.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.66 HG12 ' O ' ' A' ' 30' ' ' VAL . 34.1 pt -88.34 -28.2 5.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 120.274 -0.57 . . . . 0.4 111.661 -177.178 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 124.86 153.86 8.66 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.363 -0.922 . . . . 0.26 112.492 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.574 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 24.7 p-10 -61.44 -40.25 93.79 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.672 0.272 . . . . 0.91 111.112 -179.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 87.2 tttt -72.06 -41.68 67.11 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.364 -0.38 . . . . 3.19 110.657 -178.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.574 ' HB3' HD12 ' A' ' 34' ' ' ILE . 13.8 mmmt -64.67 -27.72 69.12 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 121.114 -0.234 . . . . 2.45 111.365 179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.4 ' O ' ' HG ' ' A' ' 43' ' ' LEU . . . -67.34 -40.2 85.84 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.053 0.454 . . . . 0.29 109.904 174.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.412 HG12 ' O ' ' A' ' 36' ' ' ASN . 45.3 mm -70.08 -40.13 78.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.079 176.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 15.5 mm-40 -58.65 -43.25 89.72 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.841 -0.618 . . . . 2.1 110.395 176.294 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.75 HD22 ' HB3' ' A' ' 73' ' ' LEU . 34.8 mt -59.98 -33.76 72.39 Favored 'General case' 0 C--O 1.221 -0.405 0 CA-C-N 116.254 -0.43 . . . . 0.29 110.846 179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.564 HD21 HG23 ' A' ' 15' ' ' ILE . 63.1 mt -62.91 -32.42 73.7 Favored 'General case' 0 C--N 1.324 -0.531 0 C-N-CA 120.879 -0.328 . . . . 1.36 110.553 179.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.7 mmm -76.97 -39.64 49.83 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.935 0.398 . . . . 2.2 110.072 171.699 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.557 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.8 mt-10 -60.5 -27.18 67.39 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 115.699 -0.682 . . . . 1.83 111.501 178.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.556 HG23 ' O ' ' A' ' 42' ' ' LEU . 72.4 p -56.86 -37.48 71.38 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-O 120.607 0.241 . . . . 1.03 110.806 177.727 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.408 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -60.67 -37.58 82.06 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.057 -0.52 . . . . 0.88 111.754 -173.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -67.57 -37.2 82.28 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.939 0.399 . . . . 2.51 110.03 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.757 HG12 HH12 ' A' ' 64' ' ' ARG . 61.4 t -76.28 -32.65 22.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-O 121.023 0.44 . . . . 0.76 110.194 176.169 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.983 ' HA ' HH22 ' A' ' 64' ' ' ARG . 33.3 mm-40 -59.64 -48.56 81.19 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 1.96 111.541 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 5.0 pp0? -69.89 -21.52 63.31 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 111.984 0.365 . . . . 2.25 111.984 -176.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 -96.99 -25.84 15.23 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 120.964 0.411 . . . . 2.34 112.001 -179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 76.27 45.62 14.52 Favored Glycine 0 CA--C 1.519 0.337 0 CA-C-N 116.011 -0.54 . . . . 1.33 113.506 176.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -102.29 129.01 9.74 Favored Glycine 0 N--CA 1.448 -0.501 0 C-N-CA 120.488 -0.863 . . . . 0.89 114.5 -178.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.925 HD13 ' HB2' ' A' ' 72' ' ' ASN . 58.9 tp -176.58 127.77 0.19 Allowed 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.229 0.538 . . . . 1.38 112.16 165.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 80.3 m-85 -121.33 108.88 14.23 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 107.563 -1.273 . . . . 2.87 107.563 162.249 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.956 HG22 " H4'" ' P' ' 600' ' ' ' A' . 0.9 OUTLIER -80.89 -174.93 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.504 0 CA-C-N 116.426 -0.352 . . . . 0.68 111.904 -174.102 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.827 ' HE3' " O3'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -55.82 -33.46 64.47 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 112.68 0.622 . . . . 0.91 112.68 -173.156 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 40.3 p30 -89.65 -36.46 15.24 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 120.179 -0.608 . . . . 2.28 112.166 -178.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 82.85 -15.34 32.36 Favored Glycine 0 CA--C 1.52 0.369 0 N-CA-C 111.734 -0.547 . . . . 1.21 111.734 -175.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 68.0 m -72.58 -59.85 2.52 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-O 121.32 0.581 . . . . 2.18 110.961 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 74.2 ttt180 -85.09 145.69 27.52 Favored 'General case' 0 N--CA 1.438 -1.037 0 N-CA-C 106.255 -1.757 . . . . 2.89 106.255 167.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -132.27 130.97 41.59 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 119.358 -0.937 . . . . 3.59 110.645 -177.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.983 HH22 ' HA ' ' A' ' 50' ' ' GLU . 9.2 tpt180 69.95 88.13 0.11 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-O 121.932 0.872 . . . . 1.98 112.359 172.686 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.764 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.3 t -110.37 147.49 36.46 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 114.83 -1.077 . . . . 0.44 109.072 172.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -45.25 -58.85 1.38 Allowed 'Trans proline' 0 N--CA 1.486 1.077 0 C-N-CA 123.939 3.093 . . . . 0.44 113.29 -176.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 1.07 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -63.46 -42.29 99.04 Favored Glycine 0 N--CA 1.445 -0.733 0 N-CA-C 110.545 -1.022 . . . . 0.25 110.545 176.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.764 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.56 -28.93 56.91 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.667 -0.767 . . . . 0.3 113.403 -179.328 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.913 HG22 ' HD2' ' A' ' 64' ' ' ARG . 22.7 t -67.53 -36.67 77.01 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.199 0.523 . . . . 0.74 110.008 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.575 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 7.6 t80 -66.08 -37.31 85.46 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.792 -0.64 . . . . 0.26 109.438 171.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -58.22 -36.8 73.68 Favored 'General case' 0 N--CA 1.464 0.255 0 N-CA-C 108.21 -1.033 . . . . 0.32 108.21 176.249 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.925 ' HB2' HD13 ' A' ' 55' ' ' LEU . 65.3 t30 -60.31 -30.91 69.8 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 115.133 -0.94 . . . . 1.08 110.302 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.75 ' HB3' HD22 ' A' ' 42' ' ' LEU . 50.5 mt -60.77 -39.53 89.15 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.831 -0.622 . . . . 0.46 112.008 -178.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.78 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.3 mp -57.68 -34.94 69.93 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.055 0.455 . . . . 1.08 110.807 -178.217 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.731 ' HG2' ' O ' ' A' ' 72' ' ' ASN . 0.3 OUTLIER -93.72 -6.02 47.13 Favored 'General case' 0 C--N 1.323 -0.58 0 O-C-N 122.209 -0.307 . . . . 1.93 110.828 -177.145 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -115.21 -27.87 7.12 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.516 -0.311 . . . . 2.12 111.759 -173.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.529 HG23 ' HB ' ' A' ' 80' ' ' ILE . 13.8 t -58.0 117.68 21.29 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-O 122.011 0.91 . . . . 0.94 110.201 -177.385 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.1 Cg_exo -72.94 -15.71 26.16 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 123.511 2.808 . . . . 1.0 113.857 -161.11 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 40.0 t -105.96 5.5 30.51 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.672 0.273 . . . . 1.49 111.649 -174.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.529 ' HB ' HG23 ' A' ' 77' ' ' THR . 34.0 mm -115.78 139.26 43.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-O 120.616 0.246 . . . . 1.21 110.792 -176.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.495 ' O ' HG12 ' A' ' 85' ' ' ILE . 39.2 t -78.68 140.96 38.3 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.204 0.526 . . . . 1.79 110.863 -177.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -64.29 -34.47 78.19 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 114.92 -1.036 . . . . 2.89 111.949 -175.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -62.78 -43.66 98.21 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.116 0.484 . . . . 2.06 110.551 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 64.7 tt0 -63.15 -28.53 70.12 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.56 -0.746 . . . . 2.31 110.398 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.78 HG23 ' HB3' ' A' ' 74' ' ' LEU . 47.1 mm -69.88 -34.42 60.17 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 115.19 -0.914 . . . . 1.41 111.461 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.535 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 4.7 tmmm? -58.78 -34.85 71.92 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.093 0.473 . . . . 2.45 110.215 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -70.88 -31.31 67.93 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.922 -0.581 . . . . 1.7 111.087 -175.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.843 HG12 HD12 ' A' ' 33' ' ' ILE . 34.8 mt -68.72 -67.82 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 N-CA-C 112.625 0.602 . . . . 0.42 112.625 -173.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.539 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -112.29 -9.28 13.89 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.515 0.931 . . . . 0.75 113.515 -169.315 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.539 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 82.7 t80 -87.91 -24.87 23.5 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-O 121.076 0.465 . . . . 1.13 110.751 -174.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.439 HG22 ' O ' ' A' ' 91' ' ' ILE . 24.2 mt -85.96 2.72 4.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.797 0.808 . . . . 0.86 109.864 177.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.588 ' OE2' ' HG ' ' A' ' 26' ' ' LEU . 45.7 tt0 -60.21 -27.61 67.32 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.145 -0.934 . . . . 2.67 111.519 -178.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -75.81 -60.8 2.16 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.3 -0.409 . . . . 4.7 111.643 -176.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.726 HE22 ' HB3' ' A' ' 97' ' ' TYR . 0.0 OUTLIER 65.75 99.82 0.04 OUTLIER 'General case' 0 N--CA 1.47 0.539 0 CA-C-O 121.261 0.553 . . . . 3.67 111.695 -177.941 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -135.97 145.14 45.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.012 -0.54 . . . . 7.97 110.5 179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 60.93 21.51 11.76 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 115.795 -0.638 . . . . 7.59 111.552 179.756 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.726 ' HB3' HE22 ' A' ' 94' ' ' GLN . 14.8 t80 -151.24 -68.8 0.18 Allowed 'General case' 0 C--N 1.324 -0.5 0 N-CA-C 109.222 -0.659 . . . . 8.84 109.222 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.447 ' H ' ' NE2' ' A' ' 94' ' ' GLN . 33.2 mt-10 56.87 50.3 12.6 Favored 'General case' 0 C--O 1.233 0.208 0 O-C-N 123.682 0.614 . . . . 10.06 111.3 169.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 -119.35 -22.96 6.86 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.895 -0.593 . . . . 12.32 111.072 -174.282 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -83.16 71.52 10.17 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.195 0.522 . . . . 14.02 111.396 -175.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -89.98 89.92 7.92 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.006 -0.543 . . . . 15.92 110.756 177.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -90.35 -96.05 0.11 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.591 -0.277 . . . . 17.13 110.297 177.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -92.41 -11.67 34.26 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.624 0.726 . . . . 18.06 109.764 176.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 30.0 tpt180 . . . . . 0 C--O 1.246 0.9 0 CA-C-N 114.93 -1.032 . . . . 19.51 108.984 179.279 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' P' P ' 600' ' ' ' A' . . . . . 0.956 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.424 -0.997 1 C3'-C2'-C1' 97.849 -4.057 . 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 601' ' ' ' U' . . . . . 0.827 " O3'" ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.511 -1.27 1 C4'-C3'-C2' 96.523 -6.177 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' P' P ' 602' ' ' ' C' . . . . . 0.635 " O2'" " H3'" ' P' ' 603' ' ' ' G' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 O4'-C4'-C3' 103.078 -1.73 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' P' P ' 603' ' ' ' G' . . . . . 0.635 " H3'" " O2'" ' P' ' 602' ' ' ' C' . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 C4'-C3'-C2' 103.474 0.774 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.738 0 N-CA-C 112.199 -0.36 . . . . 9.19 112.199 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.49 -48.19 61.44 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.477 -0.564 . . . . 7.69 109.477 175.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 75.6 mmm -132.16 -83.66 0.49 Allowed 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.334 -0.848 . . . . 7.18 109.378 170.276 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 42.69 51.14 5.04 Favored 'General case' 0 C--O 1.234 0.282 0 O-C-N 124.02 0.825 . . . . 4.5 111.694 177.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -77.73 145.27 36.63 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.387 0.613 . . . . 4.1 110.801 -177.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.423 ' HB3' HG13 ' A' ' 40' ' ' ILE . 5.1 p30 -92.42 57.13 2.91 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.439 -0.801 . . . . 1.79 111.14 -178.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.421 ' HB2' ' HB3' ' A' ' 10' ' ' LYS . 0.3 OUTLIER -63.24 119.28 9.31 Favored 'General case' 0 C--N 1.327 -0.405 0 N-CA-C 109.663 -0.495 . . . . 1.33 109.663 175.628 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.465 ' CD ' ' H ' ' A' ' 8' ' ' GLN . 21.6 mp0 -49.54 -47.97 48.67 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.098 0.407 . . . . 1.88 112.098 -167.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -64.83 -51.09 63.99 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.822 0.344 . . . . 2.17 110.915 -178.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 7' ' ' SER . 34.3 tttm -55.28 -48.11 74.54 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.725 -0.67 . . . . 2.55 110.793 177.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.778 ' O ' HG12 ' A' ' 15' ' ' ILE . 72.2 t -60.33 -53.41 49.17 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.408 0 CA-C-N 115.845 -0.616 . . . . 0.39 110.302 179.063 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB1' ' CB ' ' A' ' 28' ' ' ALA . . . -53.86 -39.29 65.54 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.261 0.553 . . . . 0.35 111.256 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -67.43 -45.46 76.0 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.494 -0.775 . . . . 0.86 110.625 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.57 ' HG2' ' HA ' ' A' ' 11' ' ' VAL . 15.4 pt-20 -76.39 -26.54 55.71 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.151 -0.477 . . . . 2.05 112.06 -176.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.778 HG12 ' O ' ' A' ' 11' ' ' VAL . 28.3 mm -56.34 -53.75 36.26 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 N-CA-C 108.946 -0.761 . . . . 0.33 108.946 176.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.673 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 22.0 p -66.52 -33.87 76.64 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-N 115.148 -0.933 . . . . 0.32 111.076 -178.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . 0.408 ' HB3' ' HA ' ' A' ' 14' ' ' GLU . 74.0 t80 -58.61 -41.7 86.48 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.054 -0.521 . . . . 0.59 110.451 175.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.536 ' HG3' ' O ' ' A' ' 14' ' ' GLU . 52.7 mtt180 -77.74 -31.97 52.44 Favored 'General case' 0 N--CA 1.45 -0.443 0 CA-C-N 116.351 -0.386 . . . . 2.83 110.859 179.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.463 HD23 ' N ' ' A' ' 19' ' ' LEU . 0.7 OUTLIER -82.67 -20.48 36.11 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.068 -0.515 . . . . 0.99 111.629 -174.688 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 58.64 33.93 23.45 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 108.12 -1.067 . . . . 1.6 108.12 -164.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.673 ' HB2' ' HA ' ' A' ' 16' ' ' SER . 0.3 OUTLIER -61.58 130.68 92.27 Favored Pre-proline 0 C--N 1.331 -0.225 0 CA-C-N 113.375 -1.739 . . . . 1.31 112.396 -173.203 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.406 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 88.2 Cg_endo -72.57 -33.04 8.99 Favored 'Trans proline' 0 CA--C 1.531 0.36 0 C-N-CA 124.125 3.217 . . . . 0.41 113.47 172.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.526 ' HD3' ' OE2' ' A' ' 92' ' ' GLU . 42.6 pttt -113.35 67.81 0.67 Allowed 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 122.084 0.945 . . . . 1.41 109.679 -174.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 28.1 mtmm -66.16 -17.8 64.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.32 -1.309 . . . . 1.75 111.49 -172.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.3 p-10 -76.19 -39.39 54.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.316 -0.402 . . . . 2.14 110.359 175.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.5 HD13 ' HD2' ' A' ' 23' ' ' LYS . 5.2 tt -73.58 -36.49 65.57 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.797 -0.446 . . . . 1.33 109.797 177.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.574 HG21 ' HB3' ' A' ' 16' ' ' SER . 1.9 tp -65.77 -27.51 41.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.626 -0.509 . . . . 0.44 109.626 176.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.707 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.3 -34.57 63.54 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.318 0.58 . . . . 0.21 110.363 171.635 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.432 ' HB3' ' O ' ' A' ' 26' ' ' LEU . 16.7 ttm180 -61.37 -47.82 84.1 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.498 -0.774 . . . . 1.48 111.5 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.715 ' O ' HG12 ' A' ' 34' ' ' ILE . 12.7 p -58.49 -37.26 63.35 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.082 0 N-CA-C 109.73 -0.47 . . . . 1.1 109.73 179.689 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.707 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 41.1 t -52.57 -53.57 19.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.426 -0.807 . . . . 0.22 110.371 173.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.87 -42.41 99.75 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.347 -0.842 . . . . 3.75 111.052 -175.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.596 HD12 HG12 ' A' ' 88' ' ' ILE . 32.7 mt -75.38 -52.15 19.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 N-CA-C 113.312 0.856 . . . . 0.8 113.312 -174.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.715 HG12 ' O ' ' A' ' 30' ' ' VAL . 31.4 pt -82.3 -21.99 9.6 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.444 0 C-N-CA 120.195 -0.602 . . . . 0.4 111.083 -176.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 114.33 146.45 9.24 Favored Glycine 0 N--CA 1.439 -1.15 0 C-N-CA 120.584 -0.817 . . . . 0.26 111.438 -178.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.433 ' O ' HG12 ' A' ' 40' ' ' ILE . 9.8 p-10 -63.42 -40.3 96.82 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 122.394 0.278 . . . . 0.91 111.519 -177.381 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.79 ' HD2' ' H ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER -72.26 -34.01 67.92 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 120.802 -0.359 . . . . 3.19 110.991 178.694 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.671 ' HG3' HD12 ' A' ' 34' ' ' ILE . 14.6 tppt? -61.7 -42.0 98.35 Favored 'General case' 0 N--CA 1.464 0.264 0 N-CA-C 110.145 -0.317 . . . . 2.45 110.145 176.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.463 ' O ' HD22 ' A' ' 43' ' ' LEU . . . -60.44 -42.39 96.01 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.051 -0.522 . . . . 0.29 110.49 176.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.433 HG12 ' O ' ' A' ' 36' ' ' ASN . 41.9 mm -61.37 -42.6 94.34 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 CA-C-N 115.89 -0.595 . . . . 1.13 110.625 177.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 37' ' ' LYS . 46.9 mt-10 -61.22 -38.23 85.88 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.236 -0.438 . . . . 2.1 110.429 177.81 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.962 HD22 ' HB3' ' A' ' 73' ' ' LEU . 75.3 mt -65.41 -31.04 71.93 Favored 'General case' 0 C--O 1.218 -0.556 0 CA-C-N 116.105 -0.498 . . . . 0.29 111.378 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.659 HD21 HD13 ' A' ' 15' ' ' ILE . 0.2 OUTLIER -62.35 -28.93 70.1 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 121.922 -0.486 . . . . 1.36 110.793 175.898 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 86.8 mtp -75.4 -35.21 61.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.322 0.582 . . . . 2.2 109.794 171.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.597 ' HB2' HD13 ' A' ' 73' ' ' LEU . 11.0 mm-40 -70.04 -26.8 64.21 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 115.536 -0.756 . . . . 1.83 111.461 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 43.3 p -57.01 -47.58 80.53 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 109.365 -0.606 . . . . 1.03 109.365 176.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.524 ' HA ' ' HB2' ' A' ' 50' ' ' GLU . . . -64.57 -35.81 82.18 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.837 -0.619 . . . . 0.88 110.914 178.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.668 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 21.9 tp10 -59.2 -49.3 78.4 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.925 -0.579 . . . . 2.51 109.566 176.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 79.7 t -70.58 -33.38 53.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.668 0 CA-C-N 116.184 -0.462 . . . . 0.76 110.821 178.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.733 ' HA ' HH22 ' A' ' 64' ' ' ARG . 6.4 mm-40 -59.94 -34.48 73.31 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.6 -0.273 . . . . 1.96 111.612 177.438 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.668 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 10.1 pt20 -83.1 -24.03 32.83 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 120.861 0.363 . . . . 2.25 110.644 179.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.1 m120 -88.8 -27.59 21.01 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.12 0.486 . . . . 2.34 111.176 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 68.58 50.27 38.26 Favored Glycine 0 CA--C 1.52 0.403 0 CA-C-N 115.745 -0.661 . . . . 1.33 113.352 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.428 ' N ' ' HE ' ' A' ' 64' ' ' ARG . . . -132.28 121.24 2.94 Favored Glycine 0 C--O 1.223 -0.55 0 C-N-CA 119.706 -1.235 . . . . 0.89 114.225 -177.006 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 1.038 HD11 HG23 ' A' ' 57' ' ' ILE . 1.9 tm? -165.23 125.51 1.88 Allowed 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.885 0.374 . . . . 1.38 110.165 171.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.525 ' N ' HD22 ' A' ' 55' ' ' LEU . 90.1 m-85 -119.16 113.73 21.36 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.77 -0.826 . . . . 2.87 108.77 171.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.038 HG23 HD11 ' A' ' 55' ' ' LEU . 0.2 OUTLIER -87.37 -161.15 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.68 0 CA-C-N 115.72 -0.673 . . . . 0.68 111.976 -175.493 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.748 ' HG3' " C3'" ' P' ' 601' ' ' ' U' . 3.2 mtt -44.49 -48.71 10.1 Favored 'General case' 0 N--CA 1.465 0.316 0 O-C-N 123.759 0.662 . . . . 0.91 110.949 -175.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.545 HD22 ' H ' ' A' ' 61' ' ' SER . 1.1 p-10 -107.98 -28.32 9.65 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.738 -0.665 . . . . 2.28 111.338 177.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 87.88 -18.84 37.14 Favored Glycine 0 C--O 1.224 -0.505 0 C-N-CA 120.853 -0.689 . . . . 1.21 112.888 178.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.545 ' H ' HD22 ' A' ' 59' ' ' ASN . 40.5 m -56.76 -45.95 81.74 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 112.161 0.43 . . . . 2.18 112.161 178.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.534 ' HD3' ' OP2' ' P' ' 602' ' ' ' C' . 35.2 mtp180 -84.43 43.17 0.94 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.932 0.873 . . . . 2.89 109.326 179.159 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.423 HH11 ' HD3' ' A' ' 63' ' ' ARG . 38.4 ttp180 -47.01 130.06 12.17 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 113.552 -1.658 . . . . 3.59 112.611 -170.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.733 HH22 ' HA ' ' A' ' 50' ' ' GLU . 0.1 OUTLIER 64.13 71.82 0.47 Allowed 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 115.248 -0.887 . . . . 1.98 112.822 -178.274 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.833 HG23 ' HA3' ' A' ' 68' ' ' GLY . 3.1 t -90.49 140.76 26.88 Favored Pre-proline 0 C--N 1.322 -0.605 0 N-CA-C 107.973 -1.121 . . . . 0.44 107.973 166.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -47.7 -58.16 1.9 Allowed 'Trans proline' 0 N--CA 1.48 0.72 0 C-N-CA 123.581 2.854 . . . . 0.44 113.262 -171.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.658 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -69.29 -40.33 81.07 Favored Glycine 0 N--CA 1.447 -0.587 0 C-N-CA 120.284 -0.96 . . . . 0.25 111.245 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.833 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -55.97 -28.2 52.75 Favored Glycine 0 CA--C 1.521 0.467 0 CA-C-N 115.515 -0.342 . . . . 0.3 113.075 -179.704 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.73 HG22 ' HD2' ' A' ' 64' ' ' ARG . 70.4 t -63.09 -39.02 83.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.483 0 CA-C-O 121.144 0.497 . . . . 0.74 110.69 176.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.443 ' CG ' HD11 ' A' ' 19' ' ' LEU . 6.9 t80 -66.32 -34.84 78.89 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.219 -0.446 . . . . 0.26 110.022 172.06 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.677 ' HG ' ' HA2' ' A' ' 68' ' ' GLY . 0.1 OUTLIER -55.3 -33.52 63.35 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 108.658 -0.867 . . . . 0.32 108.658 176.705 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.847 ' HB2' HD23 ' A' ' 55' ' ' LEU . 27.8 t-20 -56.06 -40.53 73.68 Favored 'General case' 0 C--O 1.219 -0.543 0 CA-C-N 115.954 -0.566 . . . . 1.08 109.976 174.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.962 ' HB3' HD22 ' A' ' 42' ' ' LEU . 34.5 mt -67.91 -38.15 82.57 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.599 -0.728 . . . . 0.46 111.031 -179.536 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.669 ' O ' HD12 ' A' ' 85' ' ' ILE . 5.0 tt -57.56 -38.95 75.63 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.817 -1.083 . . . . 1.08 109.734 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.686 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 12.6 pttt -93.89 -31.22 14.41 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.757 0.651 . . . . 1.93 112.757 179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 72' ' ' ASN . 0.9 OUTLIER -97.28 19.97 12.26 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 111.838 0.31 . . . . 2.12 111.838 -174.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.681 HG21 HD12 ' A' ' 80' ' ' ILE . 4.1 t -68.44 120.2 73.48 Favored Pre-proline 0 C--N 1.322 -0.599 0 N-CA-C 109.118 -0.697 . . . . 0.94 109.118 172.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.516 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 9.3 Cg_exo -71.8 -9.47 24.87 Favored 'Trans proline' 0 N--CA 1.464 -0.209 0 C-N-CA 123.077 2.518 . . . . 1.0 114.029 -166.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 77.3 p -111.23 1.25 17.09 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 112.118 0.414 . . . . 1.49 112.118 -175.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.681 HD12 HG21 ' A' ' 77' ' ' THR . 47.3 mt -119.93 140.11 45.03 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.381 0 CA-C-O 120.913 0.387 . . . . 1.21 111.493 -175.859 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . 0.416 ' O ' HG12 ' A' ' 85' ' ' ILE . 23.3 t -82.46 154.75 24.97 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 121.566 0.698 . . . . 1.79 111.003 -179.101 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.427 ' O ' ' HB ' ' A' ' 85' ' ' ILE . 27.9 tt0 -60.71 -34.06 73.81 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 114.466 -1.243 . . . . 2.89 113.182 -167.911 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -63.0 -46.91 85.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 111.842 0.312 . . . . 2.06 111.842 -175.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 tt0 -60.96 -32.55 72.09 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.209 0.528 . . . . 2.31 109.997 179.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.669 HD12 ' O ' ' A' ' 74' ' ' LEU . 30.8 mm -61.57 -44.93 99.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.169 -0.923 . . . . 1.41 110.963 178.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.58 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 36.4 ttpt -57.25 -40.69 78.14 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 115.505 -0.77 . . . . 2.45 111.516 -176.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 10.0 t70 -64.92 -31.34 72.53 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.778 -0.646 . . . . 1.7 110.971 -174.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.596 HG12 HD12 ' A' ' 33' ' ' ILE . 44.8 mt -70.0 -71.37 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 N-CA-C 112.601 0.593 . . . . 0.42 112.601 -175.064 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.509 ' CD1' HD13 ' A' ' 74' ' ' LEU . 0.0 OUTLIER -110.57 -15.7 13.82 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 113.419 0.896 . . . . 0.75 113.419 -168.368 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.58 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 81.7 t80 -71.58 -27.32 63.06 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.378 0.608 . . . . 1.13 110.614 -176.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 43.2 mt -72.51 -9.81 13.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-N 115.467 -0.788 . . . . 0.86 111.174 -178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.526 ' OE2' ' HD3' ' A' ' 23' ' ' LYS . 50.3 tt0 -61.82 -44.14 97.45 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.66 0.267 . . . . 2.67 111.099 179.89 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -103.7 -38.13 7.21 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.786 -0.365 . . . . 4.7 111.326 -178.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 33.2 mt-30 62.0 -78.29 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.362 0 C-N-CA 123.171 0.588 . . . . 3.67 112.296 -178.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 56.1 tttm -150.53 103.17 3.1 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.443 -0.577 . . . . 7.97 109.443 -178.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 83.6 mt-10 -92.1 120.06 32.36 Favored 'General case' 0 N--CA 1.45 -0.429 0 CA-C-O 121.645 0.736 . . . . 7.59 112.11 -172.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -81.83 81.72 7.75 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.698 -1.137 . . . . 8.84 110.954 171.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 75.5 tt0 -117.0 142.63 46.7 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 109.294 -0.632 . . . . 10.06 109.294 178.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.529 ' HB3' ' HG3' ' A' ' 101' ' ' LYS . 0.9 OUTLIER -89.65 -35.08 16.03 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 111.99 0.367 . . . . 12.32 111.99 -175.128 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 20.4 mmtm 61.41 26.15 15.97 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.691 -0.686 . . . . 14.02 112.335 177.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.529 ' HG3' ' HB3' ' A' ' 99' ' ' ASN . 33.8 mtmm -81.01 54.44 2.22 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.188 0.518 . . . . 15.92 110.472 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -110.72 119.3 38.68 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 116.205 -0.452 . . . . 17.13 110.862 -177.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 59.78 80.25 0.21 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.623 -0.717 . . . . 18.06 112.329 176.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 80.0 mtm180 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.801 -0.618 . . . . 19.51 109.653 174.796 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' P' P ' 600' ' ' ' A' . . . . . 0.766 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.515 -0.945 1 C3'-C2'-C1' 97.801 -4.11 . 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 601' ' ' ' U' . . . . . 0.748 " C3'" ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.507 -1.624 1 C4'-C3'-C2' 95.84 -6.86 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' P' P ' 602' ' ' ' C' . . . . . 0.534 ' OP2' ' HD3' ' A' ' 62' ' ' ARG . . . . . . . . 0 O5'--C5' 1.424 -0.989 0 C3'-C2'-C1' 100.394 -1.229 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.909 0 O4'-C1'-N19 108.971 0.771 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.784 0 N-CA-C 112.222 -0.351 . . . . 9.19 112.222 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.7 165.61 11.04 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 110.178 -0.304 . . . . 7.69 110.178 -178.498 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 63.5 mtm -97.54 69.14 2.18 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.583 -0.525 . . . . 7.18 109.583 178.714 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -117.64 59.63 0.78 Allowed 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.715 -0.675 . . . . 4.5 110.897 -176.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -70.43 -29.09 65.6 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 109.095 -0.706 . . . . 4.1 109.095 174.566 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.404 ' HB3' HD12 ' A' ' 40' ' ' ILE . 6.5 p-10 -76.91 73.25 3.52 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.051 -0.977 . . . . 1.79 110.69 176.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.48 ' O ' HG23 ' A' ' 11' ' ' VAL . 9.2 m -72.28 130.37 40.63 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.317 -0.856 . . . . 1.33 110.27 179.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.569 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 52.5 mt-30 -47.91 -47.6 32.11 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 113.275 0.843 . . . . 1.88 113.275 -169.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.0 mm-40 -67.69 -39.15 84.44 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.751 0.31 . . . . 2.17 111.259 -176.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 24.3 tptm -70.11 -36.43 74.85 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.429 -0.35 . . . . 2.55 110.576 178.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.667 ' O ' HG12 ' A' ' 15' ' ' ILE . 85.9 t -58.14 -41.38 80.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-N 116.194 -0.457 . . . . 0.39 110.794 177.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.91 -44.27 82.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.029 0.443 . . . . 0.35 111.157 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.06 -33.78 72.38 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.977 -0.556 . . . . 0.86 110.203 178.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -63.01 -43.9 97.48 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.645 -0.707 . . . . 2.05 110.647 179.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.704 HD13 HD11 ' A' ' 43' ' ' LEU . 5.0 mm -64.72 -51.0 72.89 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.124 0 N-CA-C 109.894 -0.41 . . . . 0.33 109.894 179.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.661 ' HB3' HG21 ' A' ' 27' ' ' ILE . 16.3 p -62.98 -40.55 98.07 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.739 -0.664 . . . . 0.32 111.267 -174.604 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 87.0 t80 -61.92 -45.16 94.94 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.219 -0.446 . . . . 0.59 111.178 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -74.2 -34.23 63.66 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.748 0.308 . . . . 2.83 111.785 -176.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.477 ' HB3' ' HA2' ' A' ' 67' ' ' GLY . 29.1 mt -82.49 -13.84 56.01 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.441 -0.345 . . . . 0.99 111.915 -176.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 61.51 32.04 18.85 Favored 'General case' 0 C--O 1.231 0.096 0 N-CA-C 108.333 -0.988 . . . . 1.6 108.333 -170.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.732 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 7.6 tp10 -59.39 116.44 16.29 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 114.135 -1.393 . . . . 1.31 112.171 -172.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.519 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 59.9 Cg_endo -67.07 -46.58 2.99 Favored 'Trans proline' 0 N--CA 1.472 0.26 0 C-N-CA 124.066 3.177 . . . . 0.41 113.049 173.005 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.636 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 41.7 pttt -100.88 67.91 1.25 Allowed 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.737 0.779 . . . . 1.41 109.894 -175.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -61.33 -17.95 56.25 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.128 -0.942 . . . . 1.75 112.255 -172.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -57.54 -40.74 79.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.289 0.566 . . . . 2.14 110.182 173.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.667 HD21 ' HA ' ' A' ' 89' ' ' PHE . 3.2 tm? -73.02 -45.52 57.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.396 -0.82 . . . . 1.33 110.334 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.732 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.0 tp -68.05 -28.84 42.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.997 -0.547 . . . . 0.44 111.083 -175.022 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.625 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.45 -34.67 60.96 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.962 0.41 . . . . 0.21 110.563 172.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.46 ' O ' HG12 ' A' ' 33' ' ' ILE . 12.6 ttm180 -63.08 -45.98 89.59 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.072 -0.513 . . . . 1.48 111.476 -178.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.658 ' O ' HG12 ' A' ' 34' ' ' ILE . 12.5 p -55.64 -38.69 51.33 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 CA-C-O 121.094 0.473 . . . . 1.1 109.878 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.625 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 65.3 t -54.87 -50.64 60.04 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 CA-C-N 115.167 -0.924 . . . . 0.22 110.571 173.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -61.09 -40.81 95.12 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.141 -0.936 . . . . 3.75 110.959 -177.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.625 HG13 HG12 ' A' ' 88' ' ' ILE . 39.1 mm -74.42 -48.54 35.41 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 115.993 -0.549 . . . . 0.8 112.236 -175.726 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.658 HG12 ' O ' ' A' ' 30' ' ' VAL . 32.0 pt -91.33 -29.1 4.72 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 C-N-CA 120.379 -0.529 . . . . 0.4 112.288 -174.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 119.15 161.88 11.83 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.561 -0.828 . . . . 0.26 112.612 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.569 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 2.5 p-10 -65.07 -52.67 54.34 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.785 0.326 . . . . 0.91 111.72 -178.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 18.7 ptmt -71.63 -32.9 68.46 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.924 0.392 . . . . 3.19 110.396 -177.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 7.8 mmmm -67.8 -29.91 69.21 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.8 -0.636 . . . . 2.45 111.056 179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.69 -39.99 84.41 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.078 0.466 . . . . 0.29 110.178 176.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.404 HD12 ' HB3' ' A' ' 6' ' ' ASP . 30.2 mt -69.34 -32.29 52.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.064 -0.517 . . . . 1.13 110.911 176.644 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -58.72 -38.55 78.58 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 110.099 -0.334 . . . . 2.1 110.099 173.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.845 ' HB3' HD13 ' A' ' 73' ' ' LEU . 68.4 mt -71.41 -35.2 70.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.431 -0.35 . . . . 0.29 110.204 174.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.704 HD11 HD13 ' A' ' 15' ' ' ILE . 41.1 mt -63.99 -29.93 71.05 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.201 0.524 . . . . 1.36 111.545 176.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 55.8 tpp -75.97 -35.32 59.7 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.327 0.584 . . . . 2.2 109.684 172.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -69.87 -34.38 73.5 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.292 -0.867 . . . . 1.83 111.501 -177.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 1.086 HG23 HD11 ' A' ' 73' ' ' LEU . 0.6 OUTLIER -52.0 -36.61 50.42 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 112.097 0.406 . . . . 1.03 112.097 -176.451 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -63.61 -46.51 85.4 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.628 0.233 . . . . 0.88 111.628 -175.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.45 -30.6 70.99 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 121.402 0.62 . . . . 2.51 110.276 179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.1 t -76.38 -44.86 35.3 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.363 -0.835 . . . . 0.76 110.546 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -56.14 -49.03 75.08 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 115.225 -0.898 . . . . 1.96 112.218 -179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.435 ' HG3' HD22 ' A' ' 52' ' ' ASN . 19.7 pt20 -60.75 -29.37 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.988 -0.551 . . . . 2.25 111.906 -173.311 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.435 HD22 ' HG3' ' A' ' 51' ' ' GLN . 0.9 OUTLIER -91.75 -25.22 19.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.976 0.417 . . . . 2.34 111.636 -177.927 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 115.08 -14.63 18.97 Favored Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.21 -0.519 . . . . 1.33 112.104 178.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 40.31 -81.91 0.0 OUTLIER Glycine 0 CA--C 1.528 0.899 0 N-CA-C 117.657 1.823 . . . . 0.89 117.657 167.249 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 1.059 HD11 HG23 ' A' ' 57' ' ' ILE . 2.8 tm? -74.85 132.01 41.19 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 115.252 1.575 . . . . 1.38 115.252 -156.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.57 ' N ' HD22 ' A' ' 55' ' ' LEU . 74.3 t80 -123.34 114.19 19.85 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 114.425 -1.261 . . . . 2.87 107.644 159.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.059 HG23 HD11 ' A' ' 55' ' ' LEU . 0.6 OUTLIER -87.61 -172.86 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.369 0 N-CA-C 114.125 1.158 . . . . 0.68 114.125 -168.611 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.843 ' HE3' " O3'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -55.39 -47.26 76.12 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-N 115.174 -0.921 . . . . 0.91 112.754 -172.056 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.742 HD22 ' N ' ' A' ' 60' ' ' GLY . 0.3 OUTLIER -91.62 -27.72 17.96 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 119.776 -0.77 . . . . 2.28 111.468 176.604 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.742 ' N ' HD22 ' A' ' 59' ' ' ASN . . . 82.61 -13.44 41.71 Favored Glycine 0 CA--C 1.523 0.533 0 C-N-CA 120.904 -0.665 . . . . 1.21 113.768 176.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 13.2 m -46.37 -58.48 3.69 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 122.89 0.476 . . . . 2.18 111.833 -177.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.475 ' HG3' HD11 ' A' ' 57' ' ' ILE . 3.5 ptp180 -99.89 104.71 16.38 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.223 -0.658 . . . . 2.89 109.223 173.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -72.57 127.18 31.78 Favored 'General case' 0 C--N 1.319 -0.734 0 C-N-CA 120.563 -0.455 . . . . 3.59 110.502 -178.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.756 ' HA ' ' HB3' ' A' ' 55' ' ' LEU . 8.9 tpt85 71.22 98.74 0.07 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.968 -1.014 . . . . 1.98 112.814 175.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 1.003 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.1 t -109.31 147.85 36.83 Favored Pre-proline 0 CA--C 1.536 0.44 0 CA-C-N 114.268 -1.333 . . . . 0.44 108.862 168.241 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -51.51 -59.05 1.27 Allowed 'Trans proline' 0 N--CA 1.478 0.593 0 C-N-CA 123.124 2.55 . . . . 0.44 113.076 -175.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.586 ' O ' HD23 ' A' ' 71' ' ' LEU . . . -66.22 -36.27 91.55 Favored Glycine 0 N--CA 1.445 -0.766 0 C-N-CA 120.294 -0.955 . . . . 0.25 110.721 176.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 1.003 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.18 -32.06 59.74 Favored Glycine 0 N--CA 1.446 -0.654 0 CA-C-N 114.911 -0.645 . . . . 0.3 112.927 179.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.675 ' HA ' ' HB2' ' A' ' 55' ' ' LEU . 0.4 OUTLIER -65.26 -32.57 58.83 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 117.459 0.63 . . . . 0.74 110.101 -178.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.57 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 18.6 t80 -67.42 -37.67 83.41 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 109.571 -0.529 . . . . 0.26 109.571 172.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.586 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -62.37 -34.78 77.36 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.381 -1.34 . . . . 0.32 107.381 176.549 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.733 ' HB2' HD23 ' A' ' 55' ' ' LEU . 65.7 t30 -59.67 -31.4 69.51 Favored 'General case' 0 C--N 1.341 0.231 0 CA-C-N 115.19 -0.914 . . . . 1.08 109.852 175.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 1.086 HD11 HG23 ' A' ' 46' ' ' THR . 87.8 mt -62.02 -33.1 73.73 Favored 'General case' 0 C--O 1.217 -0.621 0 CA-C-N 115.683 -0.69 . . . . 0.46 111.956 -179.446 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.665 ' HB3' HG23 ' A' ' 85' ' ' ILE . 42.1 mt -64.32 -21.28 66.56 Favored 'General case' 0 C--N 1.321 -0.635 0 C-N-CA 120.381 -0.528 . . . . 1.08 110.395 176.117 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.519 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.0 OUTLIER -85.19 -15.29 44.15 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.848 0.356 . . . . 1.93 110.641 173.468 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -115.02 4.45 14.72 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.229 -0.441 . . . . 2.12 111.428 -176.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.62 HG23 ' HB ' ' A' ' 80' ' ' ILE . 9.7 t -72.93 114.34 29.82 Favored Pre-proline 0 N--CA 1.45 -0.431 0 CA-C-O 121.758 0.79 . . . . 0.94 109.968 -175.496 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.487 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 6.2 Cg_exo -72.94 -22.16 20.11 Favored 'Trans proline' 0 CA--C 1.533 0.445 0 C-N-CA 123.039 2.492 . . . . 1.0 113.499 -165.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 30.2 m -112.85 17.4 19.01 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 113.09 0.774 . . . . 1.49 113.09 -173.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.62 ' HB ' HG23 ' A' ' 77' ' ' THR . 41.0 mm -118.3 135.9 57.23 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.416 0 CA-C-O 121.115 0.484 . . . . 1.21 111.724 -177.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 20.3 p -75.89 148.91 37.93 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.743 -0.662 . . . . 1.79 110.344 174.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -57.06 -34.48 68.3 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 114.848 -1.069 . . . . 2.89 112.962 -169.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 13.8 tt0 -70.29 -42.69 71.72 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 121.144 -0.222 . . . . 2.06 111.309 -178.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.597 ' O ' HG13 ' A' ' 88' ' ' ILE . 25.3 mt-30 -60.93 -34.46 74.74 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.934 0.397 . . . . 2.31 110.13 177.197 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.665 HG23 ' HB3' ' A' ' 74' ' ' LEU . 60.4 mt -60.69 -51.15 76.44 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 115.907 -0.588 . . . . 1.41 110.049 175.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.555 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 27.1 ttpt -54.64 -42.47 71.29 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.831 -0.622 . . . . 2.45 110.512 174.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -61.44 -35.96 79.03 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.183 -0.917 . . . . 1.7 111.714 -175.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.625 HG12 HG13 ' A' ' 33' ' ' ILE . 62.9 mt -70.94 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 N-CA-C 112.273 0.471 . . . . 0.42 112.273 -177.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.667 ' HA ' HD21 ' A' ' 26' ' ' LEU . 0.0 OUTLIER -103.4 -18.9 14.63 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 113.613 0.968 . . . . 0.75 113.613 -166.683 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.555 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 60.4 t80 -77.05 -38.94 51.67 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 120.864 0.364 . . . . 1.13 110.632 -175.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.58 ' HA ' ' HB2' ' A' ' 94' ' ' GLN . 43.4 mt -68.49 -17.05 21.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-O 121.251 0.548 . . . . 0.86 110.843 -179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -66.71 -33.5 75.77 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.58 -0.526 . . . . 2.67 109.58 177.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -85.83 -36.58 19.94 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.207 0.527 . . . . 4.7 109.971 175.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.58 ' HB2' ' HA ' ' A' ' 91' ' ' ILE . 15.5 mm100 -78.87 78.25 5.31 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.487 -0.779 . . . . 3.67 111.756 -179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 42.4 mmtm -85.82 -49.55 7.82 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.05 -0.523 . . . . 7.97 109.742 175.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 60.7 tt0 54.56 93.43 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 O-C-N 123.707 0.629 . . . . 7.59 112.497 173.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 35.1 p90 -117.48 136.98 52.84 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 109.857 -0.423 . . . . 8.84 109.857 177.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 24.1 mp0 -81.11 141.14 34.58 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.374 -0.376 . . . . 10.06 110.113 178.132 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 33.8 p-10 -135.87 27.61 3.27 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.414 -0.357 . . . . 12.32 111.352 -177.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -126.46 30.13 5.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.423 -0.353 . . . . 14.02 111.357 -176.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt 66.83 84.38 0.16 Allowed 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.834 -0.621 . . . . 15.92 111.417 179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -100.95 84.74 2.73 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.981 -0.554 . . . . 17.13 109.824 175.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -68.04 112.94 5.32 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.951 -0.568 . . . . 18.06 111.148 -178.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 20.0 tpt180 . . . . . 0 C--O 1.246 0.912 0 CA-C-O 118.664 -0.684 . . . . 19.51 109.193 179.76 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' P' P ' 600' ' ' ' A' . . . . . 0.887 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 C3'--C2' 1.515 -0.904 0 C3'-C2'-C1' 98.095 -3.784 . 0.0 '__' . 2.3 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' P' P ' 601' ' ' ' U' . . . . . 0.843 " O3'" ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.509 -1.474 1 C4'-C3'-C2' 96.488 -6.212 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' P' P ' 602' ' ' ' C' . . . . . 0.74 ' O2 ' " H2'" ' P' ' 602' ' ' ' C' . . . . . . . . 0 O5'--C5' 1.429 -0.719 0 P-O3'-C3' 121.855 1.795 . 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C3'-C2'-C1' 100.742 -0.843 . 0.0 OUTLIER gamma 7.45 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.809 0 N-CA-C 112.058 -0.417 . . . . 9.19 112.058 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -121.95 110.1 15.42 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.711 0.291 . . . . 7.69 110.841 -178.328 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 23.4 ptt? -121.18 71.63 0.96 Allowed 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.497 0.665 . . . . 7.18 111.053 179.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -108.05 43.66 1.19 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.851 -0.613 . . . . 4.5 109.541 176.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 63.57 -89.39 0.03 OUTLIER 'General case' 0 C--O 1.233 0.212 0 CA-C-N 115.158 -0.928 . . . . 4.1 110.464 -174.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.1 p-10 -94.05 66.39 3.55 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 122.032 0.92 . . . . 1.79 109.33 175.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.415 ' O ' HG23 ' A' ' 11' ' ' VAL . 14.8 m -58.95 128.55 37.77 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.873 -1.058 . . . . 1.33 110.242 178.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.809 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 49.9 mt-30 -53.23 -34.15 55.91 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.551 -0.75 . . . . 1.88 112.229 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -67.2 -48.21 68.58 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 120.833 0.349 . . . . 2.17 110.529 178.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.6 tptt -70.1 -35.85 74.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.244 -0.434 . . . . 2.55 110.727 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.696 ' O ' HG12 ' A' ' 15' ' ' ILE . 75.0 t -57.88 -56.49 15.39 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 110.05 -0.352 . . . . 0.39 110.05 176.639 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.43 -37.82 70.73 Favored 'General case' 0 C--O 1.237 0.432 0 CA-C-O 121.356 0.598 . . . . 0.35 110.962 179.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -61.57 -39.07 89.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.284 -0.871 . . . . 0.86 111.161 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.406 ' HG2' ' HD2' ' A' ' 18' ' ' ARG . 33.3 tt0 -77.78 -41.2 38.21 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 112.034 0.383 . . . . 2.05 112.034 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.696 HG12 ' O ' ' A' ' 11' ' ' VAL . 7.0 mm -55.91 -50.85 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.626 0 CA-C-O 121.029 0.443 . . . . 0.33 110.336 -175.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.645 ' HA ' ' HB3' ' A' ' 21' ' ' GLU . 7.8 p -57.59 -39.59 77.13 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.396 -0.82 . . . . 0.32 111.313 -177.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 54.4 t80 -66.46 -45.58 79.25 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.116 -0.493 . . . . 0.59 110.88 177.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.406 ' HD2' ' HG2' ' A' ' 14' ' ' GLU . 34.2 mtp180 -65.42 -43.21 91.23 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.91 -0.586 . . . . 2.83 111.723 -175.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.589 HD12 ' HA2' ' A' ' 67' ' ' GLY . 3.3 mm? -83.05 -7.57 59.64 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.14 0.422 . . . . 0.99 112.14 -178.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 56.16 37.18 28.58 Favored 'General case' 0 C--O 1.233 0.208 0 N-CA-C 108.009 -1.108 . . . . 1.6 108.009 -169.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.788 ' HG2' ' HB ' ' A' ' 27' ' ' ILE . 5.5 tp10 -60.84 117.02 21.37 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-N 113.168 -1.833 . . . . 1.31 111.309 -174.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.47 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 48.9 Cg_endo -64.16 -44.17 13.02 Favored 'Trans proline' 0 C--N 1.343 0.289 0 C-N-CA 123.708 2.939 . . . . 0.41 112.862 174.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.689 ' HE2' ' C5 ' ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -104.49 72.37 1.04 Allowed 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 122.74 1.257 . . . . 1.41 110.014 -175.792 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.494 ' O ' HG22 ' A' ' 27' ' ' ILE . 31.6 mtmm -66.12 -18.38 65.31 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 113.565 -1.652 . . . . 1.75 112.707 -167.389 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -71.21 -33.08 69.58 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.124 0.487 . . . . 2.14 109.732 178.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.903 HD11 ' HA ' ' A' ' 89' ' ' PHE . 8.7 tt -73.95 -40.51 63.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.144 -0.48 . . . . 1.33 110.26 178.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.788 ' HB ' ' HG2' ' A' ' 21' ' ' GLU . 2.9 tp -62.97 -29.73 47.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.391 0 N-CA-C 109.651 -0.499 . . . . 0.44 109.651 179.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.656 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.37 -34.74 63.42 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-O 121.403 0.62 . . . . 0.21 110.285 172.568 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 21.9 ttm180 -62.91 -41.04 99.32 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.556 -0.747 . . . . 1.48 111.125 178.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.67 ' O ' HG12 ' A' ' 34' ' ' ILE . 19.9 t -53.22 -46.37 56.24 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.193 0 N-CA-C 109.114 -0.698 . . . . 1.1 109.114 176.712 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.656 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 69.8 t -52.84 -50.33 43.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 114.153 -1.385 . . . . 0.22 111.337 175.374 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.2 mtp180 -61.02 -49.7 76.34 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.733 -0.667 . . . . 3.75 111.627 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.581 HD12 HG12 ' A' ' 88' ' ' ILE . 35.8 mt -73.89 -51.94 22.52 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 N-CA-C 112.713 0.634 . . . . 0.8 112.713 -171.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 30' ' ' VAL . 28.8 pt -83.81 -28.68 7.42 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 C-N-CA 120.058 -0.657 . . . . 0.4 111.328 -176.142 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 118.97 149.8 8.64 Favored Glycine 0 N--CA 1.444 -0.806 0 C-N-CA 120.596 -0.811 . . . . 0.26 111.66 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.809 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 1.6 p-10 -60.32 -41.34 93.31 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 112.078 0.399 . . . . 0.91 112.078 -177.33 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 21.6 ttpp -71.79 -34.81 69.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.005 0.431 . . . . 3.19 110.237 -179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.849 ' HA ' ' HG2' ' A' ' 41' ' ' GLU . 21.5 mtpp -69.69 -25.03 63.68 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 116.122 -0.49 . . . . 2.45 110.992 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -67.64 -36.42 80.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.199 0.523 . . . . 0.29 109.606 173.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 57.4 mt -72.41 -40.78 64.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 115.588 -0.733 . . . . 1.13 111.441 179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.849 ' HG2' ' HA ' ' A' ' 38' ' ' LYS . 12.8 pt-20 -67.17 -31.81 72.48 Favored 'General case' 0 C--N 1.331 -0.233 0 C-N-CA 120.726 -0.39 . . . . 2.1 110.443 -179.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.823 ' HB3' HD13 ' A' ' 73' ' ' LEU . 28.6 mt -69.39 -41.91 75.84 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 109.349 -0.612 . . . . 0.29 109.349 171.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.62 -32.85 65.7 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.811 -0.631 . . . . 1.36 111.808 -179.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 80.1 mtp -75.31 -42.36 54.81 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-O 121.136 0.493 . . . . 2.2 110.353 175.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -70.23 -25.05 63.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.799 -0.637 . . . . 1.83 111.369 -177.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.566 HG23 HD11 ' A' ' 73' ' ' LEU . 0.2 OUTLIER -56.04 -36.73 68.34 Favored 'General case' 0 N--CA 1.463 0.22 0 N-CA-C 110.087 -0.338 . . . . 1.03 110.087 178.505 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -66.54 -34.4 77.83 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 116.075 -0.511 . . . . 0.88 110.975 178.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.639 ' O ' ' HG2' ' A' ' 51' ' ' GLN . 43.9 mt-10 -71.12 -42.82 68.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.925 -0.58 . . . . 2.51 110.059 178.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 71.6 t -66.63 -33.39 63.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 CA-C-N 116.013 -0.54 . . . . 0.76 109.813 176.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.454 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 3.7 tm-20 -61.66 -51.25 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.489 -0.778 . . . . 1.96 109.662 175.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.639 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 14.8 pt20 -64.84 -18.0 64.76 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.861 0.362 . . . . 2.25 111.3 -176.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.6 m-80 -99.06 -7.88 26.11 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.546 -0.297 . . . . 2.34 111.696 -179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 65.24 35.55 91.72 Favored Glycine 0 CA--C 1.52 0.384 0 C-N-CA 121.176 -0.535 . . . . 1.33 112.81 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -97.16 109.27 3.81 Favored Glycine 0 C--O 1.226 -0.358 0 C-N-CA 120.598 -0.81 . . . . 0.89 113.785 -174.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.914 HD11 HG23 ' A' ' 57' ' ' ILE . 2.6 tm? -176.82 124.47 0.15 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.122 0.487 . . . . 1.38 110.836 169.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.457 ' N ' HD22 ' A' ' 55' ' ' LEU . 97.2 m-85 -126.0 100.89 6.55 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 108.132 -1.062 . . . . 2.87 108.132 164.748 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.914 HG23 HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -72.03 -176.15 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 112.012 0.375 . . . . 0.68 112.012 -176.687 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.665 ' HE3' " H4'" ' P' ' 601' ' ' ' U' . 0.2 OUTLIER -41.22 -45.61 2.92 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.912 -1.04 . . . . 0.91 112.573 -179.414 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.609 ' H ' HD22 ' A' ' 59' ' ' ASN . 0.1 OUTLIER -94.92 -34.88 12.24 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 112.551 0.575 . . . . 2.28 112.551 -179.582 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 84.75 -17.08 32.77 Favored Glycine 0 CA--C 1.522 0.482 0 C-N-CA 121.422 -0.418 . . . . 1.21 113.181 -178.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.57 ' HB2' ' OD1' ' A' ' 59' ' ' ASN . 68.6 m -64.12 -57.61 9.08 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.689 0.281 . . . . 2.18 111.683 -178.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.552 ' O ' HD11 ' A' ' 57' ' ' ILE . 68.7 ttt180 -81.59 81.55 7.63 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.907 -0.775 . . . . 2.89 108.907 174.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 41.6 ttp180 -71.41 126.96 31.03 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-N 115.774 -0.648 . . . . 3.59 111.167 -173.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.752 ' HD2' HG22 ' A' ' 69' ' ' VAL . 0.1 OUTLIER 70.08 58.0 0.28 Allowed 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.703 1.001 . . . . 1.98 113.703 172.618 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.804 HG21 " O2'" ' P' ' 601' ' ' ' U' . 3.7 t -78.64 143.33 62.95 Favored Pre-proline 0 C--N 1.321 -0.674 0 CA-C-N 115.221 -0.9 . . . . 0.44 109.152 169.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.433 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.3 Cg_endo -46.25 -59.61 1.15 Allowed 'Trans proline' 0 N--CA 1.486 1.03 0 C-N-CA 124.134 3.222 . . . . 0.44 113.477 -174.843 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.589 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -68.25 -34.55 80.74 Favored Glycine 0 N--CA 1.445 -0.709 0 C-N-CA 120.329 -0.939 . . . . 0.25 111.316 179.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.763 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.31 -38.65 79.58 Favored Glycine 0 N--CA 1.442 -0.925 0 CA-C-N 114.981 -0.61 . . . . 0.3 112.114 177.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.752 HG22 ' HD2' ' A' ' 64' ' ' ARG . 22.0 t -59.67 -41.44 85.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-O 121.129 0.49 . . . . 0.74 110.204 178.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.63 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 21.1 t80 -65.73 -36.83 84.71 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.687 -0.688 . . . . 0.26 110.484 175.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.645 HD13 ' HD1' ' A' ' 89' ' ' PHE . 0.1 OUTLIER -57.63 -36.77 72.26 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 108.755 -0.831 . . . . 0.32 108.755 176.819 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.882 ' HB2' HD23 ' A' ' 55' ' ' LEU . 66.5 t30 -63.05 -27.7 69.59 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.453 -0.794 . . . . 1.08 110.549 178.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.823 HD13 ' HB3' ' A' ' 42' ' ' LEU . 45.5 mt -58.22 -35.41 71.63 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-N 116.148 -0.478 . . . . 0.46 111.763 179.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.861 ' HB3' HG23 ' A' ' 85' ' ' ILE . 7.2 mp -64.4 -19.78 65.72 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 116.089 -0.505 . . . . 1.08 110.616 178.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.542 ' HD3' ' C8 ' ' P' ' 600' ' ' ' A' . 0.0 OUTLIER -82.66 -40.11 21.16 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-O 120.927 0.394 . . . . 1.93 110.151 175.655 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 90.0 m-20 -89.04 11.19 19.06 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.775 -0.648 . . . . 2.12 110.872 -177.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.578 HG21 ' HB ' ' A' ' 80' ' ' ILE . 14.7 t -64.28 131.79 95.14 Favored Pre-proline 0 C--N 1.325 -0.484 0 CA-C-O 121.752 0.787 . . . . 0.94 109.946 -177.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.508 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 7.5 Cg_exo -72.72 -47.5 0.35 Allowed 'Trans proline' 0 N--CA 1.459 -0.523 0 C-N-CA 123.284 2.656 . . . . 1.0 113.851 -169.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 7.2 m -113.53 16.76 18.69 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.499 0.926 . . . . 1.49 113.499 -172.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.578 ' HB ' HG21 ' A' ' 77' ' ' THR . 61.4 mt -119.1 138.92 48.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 C-N-CA 120.57 -0.452 . . . . 1.21 111.172 -174.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 75.3 p -98.28 167.2 11.0 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.063 0.458 . . . . 1.79 111.861 -177.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.455 ' H ' ' CD ' ' A' ' 82' ' ' GLU . 1.6 mp0 -51.9 -48.64 64.04 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 114.14 1.163 . . . . 2.89 114.14 -167.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -68.07 -37.09 80.86 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 120.567 -0.453 . . . . 2.06 111.796 -173.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.493 ' O ' HG13 ' A' ' 88' ' ' ILE . 43.1 mt-30 -62.22 -37.19 84.41 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.542 0.687 . . . . 2.31 109.26 175.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.861 HG23 ' HB3' ' A' ' 74' ' ' LEU . 82.4 mt -68.39 -49.49 65.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.499 0 CA-C-N 114.637 -1.165 . . . . 1.41 110.934 178.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.546 ' HG3' ' CD1' ' A' ' 90' ' ' TYR . 39.3 ttmt -57.25 -41.45 79.64 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.887 -0.597 . . . . 2.45 111.538 -178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.408 ' HA ' ' CD1' ' A' ' 91' ' ' ILE . 27.5 t70 -60.11 -32.92 71.44 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 121.005 0.431 . . . . 1.7 111.161 -177.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.581 HG12 HD12 ' A' ' 33' ' ' ILE . 51.8 mt -70.83 -70.84 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.632 0 CA-C-N 115.941 -0.572 . . . . 0.42 112.318 -177.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.903 ' HA ' HD11 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -106.89 -12.9 15.36 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 113.254 0.835 . . . . 0.75 113.254 -164.585 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.546 ' CD1' ' HG3' ' A' ' 86' ' ' LYS . 76.3 t80 -90.28 -38.14 13.6 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 120.793 0.33 . . . . 1.13 110.911 -172.809 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.613 HG23 ' HB3' ' A' ' 94' ' ' GLN . 51.4 mt -69.25 -64.0 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.409 0 CA-C-N 116.426 -0.352 . . . . 0.86 110.423 178.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 51.81 -90.92 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 123.783 0.833 . . . . 2.67 112.286 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -86.38 -22.1 26.81 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.131 -0.486 . . . . 4.7 111.434 -173.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . 0.613 ' HB3' HG23 ' A' ' 91' ' ' ILE . 16.9 tt0 -56.71 128.56 37.08 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-O 121.153 0.501 . . . . 3.67 111.17 -174.255 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 72.4 mmtt -100.45 111.29 23.53 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.538 -0.755 . . . . 7.97 110.453 179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -92.86 -44.25 8.58 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.137 0.494 . . . . 7.59 110.247 179.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.2 m-85 -98.87 75.85 2.11 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.295 0.569 . . . . 8.84 110.556 -177.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -82.57 -54.73 4.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.242 -0.89 . . . . 10.06 109.193 175.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 32.0 p-10 -121.93 178.02 5.06 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 114.466 -1.243 . . . . 12.32 109.258 179.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 97.9 mttt 56.7 44.53 23.5 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 121.625 0.726 . . . . 14.02 110.289 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 45.0 mtpt -81.27 6.26 14.69 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.033 -0.985 . . . . 15.92 111.367 -175.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 73.01 -31.28 0.22 Allowed 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.74 0.816 . . . . 17.13 112.478 175.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -57.25 -58.49 7.99 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.621 0.248 . . . . 18.06 110.784 179.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 33.4 ttt180 . . . . . 0 C--O 1.25 1.118 0 CA-C-O 118.573 -0.727 . . . . 19.51 110.093 176.327 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' P' P ' 600' ' ' ' A' . . . . . 0.736 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.425 -0.963 0 C4'-C3'-C2' 100.702 -1.998 . 0.0 '__' . 2.3 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' P' P ' 601' ' ' ' U' . . . . . 0.804 " O2'" HG21 ' A' ' 65' ' ' THR . . . . . . . . 0 C3'--C2' 1.509 -1.414 1 C4'-C3'-C2' 97.216 -5.484 OUTLIER-DELTA 0.0 OUTLIER gamma 0.86 . . . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' P' P ' 602' ' ' ' C' . . . . . 0.533 ' OP1' ' HG3' ' A' ' 58' ' ' MET . . . . . . . . 0 O5'--C5' 1.427 -0.842 0 C4'-C3'-C2' 105.913 3.213 OUTLIER-DELTA 0.0 OUTLIER . 7.11 . . . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' P' P ' 603' ' ' ' G' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.85 0 C4'-C3'-C2' 105.471 2.771 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.657 0 N-CA-C 112.31 -0.316 . . . . 9.19 112.31 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -100.92 116.85 33.75 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.99 0.424 . . . . 7.69 110.03 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 13.9 tpt -79.63 -63.92 1.3 Allowed 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.189 -0.46 . . . . 7.18 109.913 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 51.22 79.91 0.09 Allowed 'General case' 0 C--O 1.233 0.222 0 O-C-N 123.826 0.704 . . . . 4.5 111.126 -179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -63.04 127.83 33.07 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.17 -0.468 . . . . 4.1 111.075 -178.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -101.61 82.52 2.3 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.325 -0.62 . . . . 1.79 109.325 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.475 ' O ' HG23 ' A' ' 11' ' ' VAL . 39.1 t -63.31 119.23 9.25 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.648 -0.501 . . . . 1.33 109.648 178.88 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.839 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 16.1 mt-30 -55.87 -29.89 60.66 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 112.346 0.498 . . . . 1.88 112.346 -173.635 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -65.38 -50.17 66.53 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.084 0.469 . . . . 2.17 110.287 176.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.566 ' HE3' ' HB3' ' A' ' 13' ' ' ASP . 0.3 OUTLIER -70.25 -37.45 74.95 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.918 -0.583 . . . . 2.55 109.885 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.676 ' O ' HG12 ' A' ' 15' ' ' ILE . 69.5 t -57.14 -47.62 83.58 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 N-CA-C 110.228 -0.286 . . . . 0.39 110.228 177.579 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.23 -42.86 70.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.206 0.527 . . . . 0.35 111.029 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.566 ' HB3' ' HE3' ' A' ' 10' ' ' LYS . 35.8 t70 -70.37 -39.73 74.41 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.687 -0.688 . . . . 0.86 110.537 178.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.415 ' CD ' ' HE ' ' A' ' 18' ' ' ARG . 7.6 tp10 -61.46 -45.2 95.26 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.118 -0.947 . . . . 2.05 111.292 -177.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.676 HG12 ' O ' ' A' ' 11' ' ' VAL . 5.2 mm -59.98 -52.17 64.33 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.299 0 CA-C-O 121.067 0.461 . . . . 0.33 109.925 -178.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.624 ' HB3' HG21 ' A' ' 27' ' ' ILE . 19.4 p -64.95 -38.88 92.45 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.642 -0.708 . . . . 0.32 111.32 -175.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.7 t80 -59.23 -45.61 90.68 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.783 -0.644 . . . . 0.59 110.949 178.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.415 ' HE ' ' CD ' ' A' ' 14' ' ' GLU . 75.0 mtt180 -79.04 -33.7 44.5 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.603 -0.272 . . . . 2.83 111.529 -177.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.941 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.2 mm? -79.29 -9.4 59.57 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 112.445 0.535 . . . . 0.99 112.445 -177.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 58.57 34.65 24.03 Favored 'General case' 0 N--CA 1.464 0.269 0 N-CA-C 108.079 -1.082 . . . . 1.6 108.079 -171.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.584 ' HG2' ' O4 ' ' P' ' 601' ' ' ' U' . 1.3 tm-20 -71.8 126.07 91.52 Favored Pre-proline 0 C--N 1.324 -0.514 0 CA-C-N 114.089 -1.414 . . . . 1.31 111.91 -165.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.46 ' HG2' ' HG2' ' A' ' 23' ' ' LYS . 73.6 Cg_endo -69.93 -46.65 1.08 Allowed 'Trans proline' 0 N--CA 1.476 0.463 0 C-N-CA 124.657 3.571 . . . . 0.41 114.345 178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.708 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 33.0 pttt -109.85 66.4 0.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.382 0.611 . . . . 1.41 110.494 -169.012 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.551 ' HA ' HG22 ' A' ' 27' ' ' ILE . 83.6 mttt -59.32 -12.44 5.7 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 114.523 -1.217 . . . . 1.75 113.411 -167.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -63.13 -46.61 86.43 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.374 0.607 . . . . 2.14 109.662 174.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.61 HD11 ' HA ' ' A' ' 89' ' ' PHE . 6.6 tt -73.36 -41.57 63.26 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.289 -0.868 . . . . 1.33 110.812 -177.065 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.624 HG21 ' HB3' ' A' ' 16' ' ' SER . 6.4 tp -65.87 -30.04 48.8 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 CA-C-O 121.004 0.43 . . . . 0.44 110.413 -177.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.703 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -74.18 -33.82 63.57 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 121.579 0.704 . . . . 0.21 110.333 173.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.413 ' O ' HG12 ' A' ' 33' ' ' ILE . 38.7 ttm180 -63.03 -39.15 93.89 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.296 -0.865 . . . . 1.48 111.763 -179.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.662 HG21 ' HE1' ' A' ' 70' ' ' PHE . 23.1 t -52.78 -43.16 44.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 N-CA-C 109.128 -0.693 . . . . 1.1 109.128 177.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.703 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.0 t -53.18 -50.07 48.22 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-N 114.278 -1.328 . . . . 0.22 110.855 173.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 40.7 mmt180 -59.49 -43.82 93.23 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.22 -0.9 . . . . 3.75 111.429 -177.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.778 HG13 HG12 ' A' ' 88' ' ' ILE . 38.9 mm -75.55 -49.73 26.03 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-N 115.723 -0.672 . . . . 0.8 112.5 -173.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 30' ' ' VAL . 36.4 pt -94.76 -29.07 4.1 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 N-CA-C 112.604 0.594 . . . . 0.4 112.604 -172.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 129.33 162.17 10.81 Favored Glycine 0 CA--C 1.52 0.361 0 C-N-CA 120.556 -0.83 . . . . 0.26 112.673 -178.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.839 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 20.4 p-10 -67.59 -55.99 11.21 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 122.515 0.326 . . . . 0.91 111.667 -177.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 19.0 tptm -71.56 -33.85 69.46 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 109.869 -0.419 . . . . 3.19 109.869 -179.255 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.428 ' HG3' ' O ' ' A' ' 34' ' ' ILE . 5.9 mmmm -56.83 -38.3 72.44 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.855 -0.611 . . . . 2.45 110.914 176.23 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.451 ' O ' HD22 ' A' ' 43' ' ' LEU . . . -71.42 -38.85 71.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.062 -0.517 . . . . 0.29 110.869 177.502 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.805 ' HA ' HD23 ' A' ' 43' ' ' LEU . 22.3 mt -71.42 -33.26 49.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 CA-C-N 116.45 -0.341 . . . . 1.13 111.308 -179.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -61.46 -33.76 74.3 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 120.995 0.426 . . . . 2.1 110.179 173.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.839 HD22 ' HB3' ' A' ' 73' ' ' LEU . 79.0 mt -62.73 -36.7 83.84 Favored 'General case' 0 N--CA 1.455 -0.21 0 CA-C-N 115.914 -0.585 . . . . 0.29 110.47 174.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.805 HD23 ' HA ' ' A' ' 40' ' ' ILE . 0.6 OUTLIER -57.47 -32.73 67.26 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 120.575 0.226 . . . . 1.36 111.036 178.222 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 78.7 mmm -71.41 -39.52 71.07 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.993 0.425 . . . . 2.2 110.544 176.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -70.88 -24.46 62.49 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 116.129 -0.487 . . . . 1.83 111.886 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.601 HG22 HD11 ' A' ' 73' ' ' LEU . 43.1 p -54.47 -42.36 70.6 Favored 'General case' 0 N--CA 1.464 0.258 0 C-N-CA 120.55 -0.46 . . . . 1.03 109.877 175.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.25 -39.99 76.72 Favored 'General case' 0 C--N 1.334 -0.105 0 CA-C-N 116.107 -0.497 . . . . 0.88 111.032 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -62.86 -46.91 85.67 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.629 -0.714 . . . . 2.51 110.655 179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 47.5 t -76.4 -32.08 21.38 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-N 116.339 -0.392 . . . . 0.76 111.263 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.883 ' HA ' ' NH2' ' A' ' 64' ' ' ARG . 22.2 mt-10 -67.35 -38.94 85.63 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 111.913 0.338 . . . . 1.96 111.913 -179.803 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -71.07 -19.05 62.52 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.852 0.358 . . . . 2.25 111.224 -179.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.1 m-20 -106.31 -25.06 12.1 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.286 -0.415 . . . . 2.34 112.088 -176.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 74.86 50.21 9.23 Favored Glycine 0 CA--C 1.52 0.361 0 CA-C-N 116.007 -0.542 . . . . 1.33 113.6 174.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -109.7 118.43 5.13 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.123 -1.036 . . . . 0.89 114.606 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.729 ' HB3' ' HA ' ' A' ' 64' ' ' ARG . 46.6 tp -177.97 131.63 0.15 Allowed 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 112.471 0.545 . . . . 1.38 112.471 168.26 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -124.65 101.52 7.16 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.107 -1.071 . . . . 2.87 108.107 165.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.713 ' HA ' " O4'" ' P' ' 600' ' ' ' A' . 0.0 OUTLIER -68.85 -167.23 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.516 0 N-CA-C 113.595 0.961 . . . . 0.68 113.595 -169.422 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.64 ' HE3' " H4'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -41.58 -48.01 3.94 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 114.534 -1.212 . . . . 0.91 111.52 177.902 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.576 HD22 ' N ' ' A' ' 61' ' ' SER . 4.2 t30 -116.02 -37.01 3.95 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.962 0.41 . . . . 2.28 111.008 173.082 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.507 ' HA2' HG13 ' A' ' 57' ' ' ILE . . . 98.69 8.02 54.91 Favored Glycine 0 N--CA 1.446 -0.662 0 C-N-CA 120.23 -0.986 . . . . 1.21 111.354 -171.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.576 ' N ' HD22 ' A' ' 59' ' ' ASN . 5.3 p -54.66 -53.7 51.28 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.319 0.58 . . . . 2.18 110.867 -178.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.543 ' C ' HD11 ' A' ' 57' ' ' ILE . 5.0 ptp180 -112.12 53.58 0.73 Allowed 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 108.6 -0.889 . . . . 2.89 108.6 171.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . 0.458 ' HA ' ' CG1' ' A' ' 57' ' ' ILE . 14.9 ptp180 -50.36 132.42 24.61 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 114.786 -1.097 . . . . 3.59 112.211 -168.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.883 ' NH2' ' HA ' ' A' ' 50' ' ' GLU . 19.3 tpt85 68.26 44.82 1.32 Allowed 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 121.992 0.901 . . . . 1.98 111.251 174.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.698 ' O ' HG23 ' A' ' 69' ' ' VAL . 4.7 t -74.14 144.01 81.25 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 114.891 -1.049 . . . . 0.44 110.176 173.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -46.27 -59.54 1.18 Allowed 'Trans proline' 0 N--CA 1.485 1.016 0 C-N-CA 124.365 3.377 . . . . 0.44 113.883 -174.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.941 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -66.97 -35.3 89.25 Favored Glycine 0 N--CA 1.449 -0.486 0 C-N-CA 120.267 -0.968 . . . . 0.25 111.115 179.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.648 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -58.33 -32.61 68.37 Favored Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 114.821 -0.689 . . . . 0.3 112.227 176.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.824 HG22 ' HD2' ' A' ' 64' ' ' ARG . 17.1 t -63.71 -35.04 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.304 0 CA-C-O 121.223 0.535 . . . . 0.74 110.561 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.662 ' HE1' HG21 ' A' ' 30' ' ' VAL . 14.5 t80 -65.29 -35.6 81.52 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.887 -0.597 . . . . 0.26 109.813 174.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.84 ' HB2' H5'' ' P' ' 600' ' ' ' A' . 0.3 OUTLIER -60.21 -34.8 74.15 Favored 'General case' 0 CA--C 1.529 0.16 0 N-CA-C 107.961 -1.125 . . . . 0.32 107.961 177.228 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.685 ' HB2' HD13 ' A' ' 55' ' ' LEU . 54.1 t30 -63.08 -27.13 69.18 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.326 -0.852 . . . . 1.08 110.072 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.839 ' HB3' HD22 ' A' ' 42' ' ' LEU . 67.7 mt -61.05 -33.4 73.24 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.834 -0.621 . . . . 0.46 111.253 175.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.763 ' HB3' HG23 ' A' ' 85' ' ' ILE . 8.4 mp -63.98 -20.38 65.85 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.143 -0.48 . . . . 1.08 109.983 175.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.823 ' HZ1' HG21 ' A' ' 85' ' ' ILE . 0.0 OUTLIER -85.11 -45.26 12.25 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 121.363 0.602 . . . . 1.93 109.837 172.046 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -81.58 9.11 8.13 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.133 -0.94 . . . . 2.12 111.379 -176.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.622 ' CG2' ' HB ' ' A' ' 80' ' ' ILE . 9.9 t -68.47 122.47 84.64 Favored Pre-proline 0 N--CA 1.446 -0.668 0 N-CA-C 108.899 -0.778 . . . . 0.94 108.899 176.111 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 21.1 Cg_exo -65.87 -39.33 20.12 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 122.839 2.36 . . . . 1.0 113.629 -164.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 19.5 m -113.23 5.66 17.07 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 113.298 0.851 . . . . 1.49 113.298 -175.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.622 ' HB ' ' CG2' ' A' ' 77' ' ' THR . 62.7 mt -113.24 138.94 41.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 O-C-N 121.862 -0.524 . . . . 1.21 111.283 -174.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 3.2 p -97.12 155.15 16.94 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.436 0.636 . . . . 1.79 111.656 -177.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' A' ' 86' ' ' LYS . 57.3 mm-40 -59.37 -27.03 65.59 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 114.076 1.139 . . . . 2.89 114.076 -171.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -57.85 -43.92 86.22 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 118.676 0.671 . . . . 2.06 110.916 179.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.453 ' O ' HG13 ' A' ' 88' ' ' ILE . 75.6 mm-40 -67.36 -26.52 66.52 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.79 0.805 . . . . 2.31 109.157 177.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.823 HG21 ' HZ1' ' A' ' 75' ' ' LYS . 51.1 mm -75.9 -38.92 37.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.724 0 CA-C-N 114.464 -1.244 . . . . 1.41 112.113 -175.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 82' ' ' GLU . 8.0 mttm -57.7 -43.29 85.07 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 108.71 -0.848 . . . . 2.45 108.71 177.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -59.32 -32.89 70.49 Favored 'General case' 0 N--CA 1.439 -0.988 0 CA-C-N 113.885 -1.507 . . . . 1.7 109.862 -175.105 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.778 HG12 HG13 ' A' ' 33' ' ' ILE . 49.1 mt -71.94 -64.94 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 CA-C-N 114.995 -1.002 . . . . 0.42 112.22 178.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.722 ' HD2' ' N ' ' A' ' 90' ' ' TYR . 0.0 OUTLIER -108.32 -19.05 13.6 Favored 'General case' 0 CA--C 1.531 0.246 0 N-CA-C 114.77 1.396 . . . . 0.75 114.77 -167.368 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.722 ' N ' ' HD2' ' A' ' 89' ' ' PHE . 89.3 t80 -76.88 -34.11 57.78 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 118.396 0.543 . . . . 1.13 110.454 -174.133 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 50.6 mt -69.19 -20.94 24.83 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.054 -0.521 . . . . 0.86 110.325 178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 54.84 -92.59 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.358 -0.837 . . . . 2.67 111.305 -179.238 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -142.94 36.0 1.39 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-O 121.608 0.718 . . . . 4.7 109.912 177.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 69.1 mt-30 -91.23 23.38 3.34 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.677 -0.692 . . . . 3.67 110.154 172.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 16.4 ttpp -81.37 65.84 6.67 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.624 -0.716 . . . . 7.97 110.596 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -90.47 -50.98 5.64 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.038 -0.528 . . . . 7.59 110.0 177.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 15.2 m-85 -87.97 151.7 22.59 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.947 -0.569 . . . . 8.84 110.687 177.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -83.98 99.41 10.39 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.932 -0.576 . . . . 10.06 110.31 -177.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 26.5 t-20 -88.51 -14.44 37.77 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 115.947 -0.57 . . . . 12.32 111.191 -174.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -68.53 124.48 23.7 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.373 -0.376 . . . . 14.02 110.322 -179.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . 0.494 ' H ' ' HD2' ' A' ' 101' ' ' LYS . 0.0 OUTLIER -78.22 98.13 5.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.044 -0.525 . . . . 15.92 111.552 -172.428 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -82.15 64.49 6.85 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.167 -0.47 . . . . 17.13 110.081 174.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -138.9 30.52 2.25 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.711 -0.677 . . . . 18.06 110.218 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 . . . . . 0 C--O 1.247 0.933 0 CA-C-N 115.299 -0.864 . . . . 19.51 110.128 -178.076 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' P' P ' 600' ' ' ' A' . . . . . 0.84 H5'' ' HB2' ' A' ' 71' ' ' LEU . . . . . . . . 0 O5'--C5' 1.429 -0.706 0 C4'-C3'-C2' 99.892 -2.808 OUTLIER-DELTA 0.0 '__' . 2.3 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 601' ' ' ' U' . . . . . 0.708 ' C6 ' ' HE2' ' A' ' 23' ' ' LYS . . . . . . . . 0 C3'--C2' 1.513 -1.129 1 C4'-C3'-C2' 97.83 -4.87 OUTLIER-EPSILON 0.0 OUTLIER gamma 0.86 . . . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' P' P ' 602' ' ' ' C' . . . . . 0.508 ' H41' ' HD3' ' A' ' 23' ' ' LYS . . . . . . . . 0 O5'--C5' 1.426 -0.881 0 P-O3'-C3' 124.432 3.943 . 0.0 OUTLIER epsilon-1 7.11 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' P' P ' 603' ' ' ' G' . . . . . 0.704 " H3'" ' N3 ' ' P' ' 603' ' ' ' G' . . . . . . . . 0 O5'--C5' 1.426 -0.857 0 C4'-C3'-C2' 104.468 1.768 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.663 0 N-CA-C 112.029 -0.428 . . . . 9.19 112.029 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -104.37 21.62 16.33 Favored 'General case' 0 C--N 1.327 -0.403 0 O-C-N 122.829 -0.218 . . . . 7.69 111.33 -175.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 65.8 mtt 59.34 43.33 16.81 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.144 -0.48 . . . . 7.18 111.325 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 64.27 36.5 9.24 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.578 -0.737 . . . . 4.5 112.072 175.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -96.18 12.67 29.99 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.467 0.651 . . . . 4.1 110.296 173.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -78.97 66.51 4.44 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.278 -0.874 . . . . 1.79 109.303 173.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t -73.94 139.6 45.01 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 108.783 -0.821 . . . . 1.33 108.783 177.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.614 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 61.2 mt-30 -48.54 -45.77 37.9 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 112.974 0.731 . . . . 1.88 112.974 -169.173 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -63.67 -42.76 98.01 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.868 0.366 . . . . 2.17 110.706 -179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -70.39 -37.13 74.46 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.04 0.448 . . . . 2.55 110.044 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.704 HG13 HD11 ' A' ' 15' ' ' ILE . 49.3 t -56.66 -51.91 60.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 115.634 -0.712 . . . . 0.39 110.865 177.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -54.18 -33.94 59.31 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.156 0.503 . . . . 0.35 111.206 -179.259 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -70.38 -41.66 72.78 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.824 -0.625 . . . . 0.86 110.789 178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -72.89 -42.63 63.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.372 -0.376 . . . . 2.05 111.597 -175.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.865 HD12 HD21 ' A' ' 43' ' ' LEU . 1.3 mm -58.68 -48.04 87.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.49 0 C-N-CA 120.34 -0.544 . . . . 0.33 110.209 -177.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.666 ' HA ' ' HB2' ' A' ' 21' ' ' GLU . 21.7 p -64.57 -34.61 78.67 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.667 -0.697 . . . . 0.32 110.899 -177.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 77.3 t80 -68.49 -44.06 75.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.196 -0.457 . . . . 0.59 110.481 175.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 22.9 mtp180 -69.46 -46.28 67.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.906 -0.588 . . . . 2.83 111.72 -176.629 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.842 HD12 ' HA2' ' A' ' 67' ' ' GLY . 4.2 mm? -85.1 1.43 47.88 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 112.087 0.402 . . . . 0.99 112.087 -175.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 55.68 33.17 20.77 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.241 0.543 . . . . 1.6 109.561 -175.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.694 ' HG3' ' HB ' ' A' ' 27' ' ' ILE . 0.0 OUTLIER -60.08 116.77 18.77 Favored Pre-proline 0 C--N 1.325 -0.467 0 CA-C-N 114.623 -1.171 . . . . 1.31 112.694 -168.031 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.472 ' HD2' ' HA ' ' A' ' 21' ' ' GLU . 52.5 Cg_endo -63.45 -40.26 32.15 Favored 'Trans proline' 0 CA--C 1.531 0.352 0 C-N-CA 124.011 3.141 . . . . 0.41 113.33 172.326 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.577 ' HE2' ' C6 ' ' P' ' 601' ' ' ' U' . 41.9 pttt -109.0 68.56 0.68 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.824 0.821 . . . . 1.41 109.463 -172.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.679 ' HA ' HG22 ' A' ' 27' ' ' ILE . 50.4 mttp -62.77 -12.56 24.98 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 114.68 -1.146 . . . . 1.75 113.542 -166.54 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -75.42 -33.85 60.97 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.117 0.484 . . . . 2.14 110.115 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.63 HD11 ' HA ' ' A' ' 89' ' ' PHE . 0.6 OUTLIER -73.57 -47.33 41.37 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.861 -0.609 . . . . 1.33 110.171 -178.548 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.694 ' HB ' ' HG3' ' A' ' 21' ' ' GLU . 11.0 tp -62.97 -29.43 47.18 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.216 -0.447 . . . . 0.44 110.895 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.658 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -73.94 -33.42 63.91 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-O 121.061 0.457 . . . . 0.21 110.673 174.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 88' ' ' ILE . 14.0 ttm180 -58.15 -40.15 80.63 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.032 -0.531 . . . . 1.48 110.874 178.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.539 HG21 ' HE1' ' A' ' 70' ' ' PHE . 23.3 t -53.06 -44.7 51.68 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.345 0 CA-C-O 121.487 0.66 . . . . 1.1 109.535 177.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.658 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 82.0 t -52.95 -50.37 44.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 114.19 -1.368 . . . . 0.22 111.149 176.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.6 ttt180 -66.07 -41.92 90.13 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.298 -0.865 . . . . 3.75 111.14 -175.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.493 HG13 HG12 ' A' ' 88' ' ' ILE . 50.1 mm -74.67 -50.27 26.76 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.897 -0.592 . . . . 0.8 112.541 -172.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.527 HG12 ' O ' ' A' ' 30' ' ' VAL . 33.1 pt -95.56 -29.49 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.199 0 C-N-CA 120.106 -0.638 . . . . 0.4 111.902 -174.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 123.33 160.81 10.98 Favored Glycine 0 N--CA 1.447 -0.575 0 C-N-CA 120.401 -0.904 . . . . 0.26 112.651 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.614 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 3.0 p-10 -67.84 -48.61 65.7 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.49 0.186 . . . . 0.91 111.409 -177.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.412 ' HE3' ' HB2' ' A' ' 37' ' ' LYS . 19.4 ptmt -71.73 -33.09 68.43 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 121.067 0.461 . . . . 3.19 109.876 -178.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -64.31 -32.2 73.7 Favored 'General case' 0 N--CA 1.453 -0.302 0 CA-C-N 116.016 -0.538 . . . . 2.45 109.844 176.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -69.24 -42.52 75.53 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.869 -0.605 . . . . 0.29 109.991 173.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.772 ' HA ' ' HG ' ' A' ' 43' ' ' LEU . 44.8 mm -59.96 -37.68 73.3 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 CA-C-O 120.921 0.391 . . . . 1.13 110.672 177.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 45' ' ' GLU . 14.4 mm-40 -54.33 -46.45 72.9 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.236 -0.653 . . . . 2.1 109.236 173.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.944 HD22 ' HB3' ' A' ' 73' ' ' LEU . 72.2 mt -65.63 -43.18 90.29 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.268 -0.878 . . . . 0.29 111.279 179.036 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.865 HD21 HD12 ' A' ' 15' ' ' ILE . 4.8 mt -56.68 -38.74 72.65 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-O 121.024 0.44 . . . . 1.36 110.334 -177.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 44.0 tpp -74.69 -39.78 61.77 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.215 -0.448 . . . . 2.2 109.926 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 41' ' ' GLU . 40.6 mt-10 -70.01 -23.69 63.17 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.721 -0.672 . . . . 1.83 112.172 -179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.54 HG23 ' O ' ' A' ' 42' ' ' LEU . 71.6 p -51.1 -49.11 61.35 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.715 0.293 . . . . 1.03 110.25 178.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -62.32 -36.62 82.72 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.724 -0.671 . . . . 0.88 111.481 -177.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' GLN . 36.6 mt-10 -66.94 -40.22 87.52 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.153 0.502 . . . . 2.51 110.389 -179.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -76.85 -33.51 21.34 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.617 0 CA-C-N 116.065 -0.516 . . . . 0.76 110.495 177.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.536 ' HG3' ' O ' ' A' ' 46' ' ' THR . 40.5 mt-10 -58.44 -51.47 69.71 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-N 116.344 -0.389 . . . . 1.96 111.27 176.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 5.3 pp0? -63.72 -22.76 67.07 Favored 'General case' 0 C--N 1.331 -0.198 0 O-C-N 123.371 0.419 . . . . 2.25 111.085 -176.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -89.47 -12.65 39.53 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.341 0.591 . . . . 2.34 110.394 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 73.45 28.93 64.75 Favored Glycine 0 N--CA 1.451 -0.361 0 CA-C-N 115.673 -0.694 . . . . 1.33 112.488 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.422 ' O ' ' HB2' ' A' ' 55' ' ' LEU . . . -89.48 101.27 2.75 Favored Glycine 0 N--CA 1.448 -0.554 0 C-N-CA 120.678 -0.772 . . . . 0.89 113.889 -174.018 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 1.11 HD11 HG23 ' A' ' 57' ' ' ILE . 2.7 tm? -176.62 124.57 0.17 Allowed 'General case' 0 C--N 1.333 -0.138 0 CA-C-O 121.102 0.477 . . . . 1.38 111.268 170.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -124.6 105.03 9.04 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 108.24 -1.022 . . . . 2.87 108.24 164.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.11 HG23 HD11 ' A' ' 55' ' ' LEU . 0.5 OUTLIER -77.5 -179.45 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.709 0 N-CA-C 112.583 0.586 . . . . 0.68 112.583 -171.02 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.749 ' HE3' " O3'" ' P' ' 601' ' ' ' U' . 0.1 OUTLIER -52.47 -43.93 65.28 Favored 'General case' 0 N--CA 1.454 -0.225 0 CA-C-N 115.778 -0.646 . . . . 0.91 111.481 -176.799 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 22.5 p-10 -90.49 -37.54 13.83 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.938 0.399 . . . . 2.28 110.989 178.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 83.75 -14.87 39.83 Favored Glycine 0 CA--C 1.52 0.358 0 C-N-CA 121.163 -0.541 . . . . 1.21 112.703 177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.28 -57.78 11.51 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-O 120.892 0.377 . . . . 2.18 111.253 -176.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.8 ptp180 -96.41 55.69 1.5 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.536 0.684 . . . . 2.89 109.605 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 30.5 ptt180 -53.89 146.36 14.29 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.127 -0.942 . . . . 3.59 111.795 -174.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.643 ' H ' HD12 ' A' ' 55' ' ' LEU . 0.0 OUTLIER 61.95 49.83 4.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.629 -1.169 . . . . 1.98 112.621 -177.815 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.864 HG23 ' HA3' ' A' ' 68' ' ' GLY . 1.8 t -75.51 142.01 73.78 Favored Pre-proline 0 C--N 1.32 -0.701 0 CA-C-N 115.256 -0.883 . . . . 0.44 109.457 169.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -47.31 -59.12 1.37 Allowed 'Trans proline' 0 N--CA 1.482 0.838 0 C-N-CA 123.831 3.021 . . . . 0.44 112.808 -175.533 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.842 ' HA2' HD12 ' A' ' 19' ' ' LEU . . . -62.65 -39.19 97.59 Favored Glycine 0 N--CA 1.447 -0.604 0 N-CA-C 111.018 -0.833 . . . . 0.25 111.018 177.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.864 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.79 -31.97 61.44 Favored Glycine 0 N--CA 1.447 -0.579 0 CA-C-N 114.866 -0.667 . . . . 0.3 112.868 179.121 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.655 HG23 ' O ' ' A' ' 65' ' ' THR . 11.0 t -66.13 -38.33 81.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-O 121.124 0.487 . . . . 0.74 109.891 179.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.539 ' HE1' HG21 ' A' ' 30' ' ' VAL . 5.9 t80 -66.41 -38.69 88.03 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.162 -0.472 . . . . 0.26 109.932 171.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.705 HD23 ' O ' ' A' ' 67' ' ' GLY . 0.1 OUTLIER -57.0 -34.52 68.23 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.83 -0.804 . . . . 0.32 108.83 176.19 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.831 ' HB2' HD23 ' A' ' 55' ' ' LEU . 6.0 t30 -59.59 -38.94 82.56 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.559 -0.746 . . . . 1.08 110.154 176.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.944 ' HB3' HD22 ' A' ' 42' ' ' LEU . 70.9 mt -58.35 -35.06 71.37 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 115.55 -0.75 . . . . 0.46 112.084 -179.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.594 ' HB3' HG23 ' A' ' 85' ' ' ILE . 14.7 mt -57.54 -47.02 83.14 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 116.326 -0.397 . . . . 1.08 110.961 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.645 ' HE3' ' HA ' ' A' ' 72' ' ' ASN . 0.1 OUTLIER -93.03 -7.75 44.86 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.142 -0.623 . . . . 1.93 111.808 -179.091 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -98.82 -18.0 18.17 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.221 -0.445 . . . . 2.12 111.013 -178.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.535 HG21 HD12 ' A' ' 80' ' ' ILE . 10.1 t -58.6 126.22 78.93 Favored Pre-proline 0 C--N 1.328 -0.345 0 CA-C-O 121.698 0.761 . . . . 0.94 110.973 -176.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.507 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 5.2 Cg_exo -73.91 -25.75 13.93 Favored 'Trans proline' 0 N--CA 1.46 -0.45 0 C-N-CA 123.31 2.674 . . . . 1.0 113.282 -171.219 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 23.0 t -101.35 -2.54 30.72 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.175 0.435 . . . . 1.49 112.175 -170.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.535 HD12 HG21 ' A' ' 77' ' ' THR . 36.2 mt -119.29 136.87 55.07 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 O-C-N 121.931 -0.481 . . . . 1.21 110.911 -176.524 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 8.7 t -85.25 153.87 22.32 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.182 0.515 . . . . 1.79 110.578 -176.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -63.86 -30.35 71.45 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 115.306 -0.861 . . . . 2.89 112.942 -167.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -68.41 -36.88 79.74 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.94 -0.304 . . . . 2.06 111.437 -176.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -66.2 -36.08 82.12 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.61 0.719 . . . . 2.31 109.536 174.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.594 HG23 ' HB3' ' A' ' 74' ' ' LEU . 45.8 mm -74.97 -36.62 39.2 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 114.878 -1.056 . . . . 1.41 111.629 -177.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.537 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 23.0 ttmm -51.55 -39.22 57.37 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.65 -0.705 . . . . 2.45 111.49 -179.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -71.41 -33.1 69.14 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.053 -0.521 . . . . 1.7 111.498 -176.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.501 HG21 HG22 ' A' ' 30' ' ' VAL . 57.7 mt -65.96 -67.7 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.738 0 N-CA-C 112.569 0.581 . . . . 0.42 112.569 -170.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.826 ' H ' ' HD2' ' A' ' 89' ' ' PHE . 0.0 OUTLIER -112.05 -27.56 8.35 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.466 0.543 . . . . 0.75 112.466 -170.596 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.537 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 67.7 t80 -67.35 -36.35 81.22 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.109 0.481 . . . . 1.13 111.233 -172.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.6 mt -65.16 -45.31 94.38 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-N 115.742 -0.663 . . . . 0.86 110.279 177.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 58.39 -92.24 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.457 -0.792 . . . . 2.67 111.798 175.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.2 p-10 -124.12 7.18 8.53 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.825 0.345 . . . . 4.7 110.802 -176.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -66.0 110.73 3.03 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.993 -0.548 . . . . 3.67 111.139 -176.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 61.7 mttp -125.13 157.38 36.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.999 -0.546 . . . . 7.97 109.834 177.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -127.31 -32.93 2.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 116.253 -0.431 . . . . 7.59 111.131 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -91.07 36.92 0.92 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.957 0.408 . . . . 8.84 110.84 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -97.14 134.69 40.14 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 109.65 -0.5 . . . . 10.06 109.65 177.328 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 6.1 p30 -156.61 150.41 24.82 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 116.163 -0.471 . . . . 12.32 110.858 -177.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 17.7 pttp -177.1 -41.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.605 -0.725 . . . . 14.02 109.701 -179.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -160.38 98.24 1.26 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.022 -0.535 . . . . 15.92 109.783 173.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . 60.94 30.29 19.53 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.617 -0.719 . . . . 17.13 111.214 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . 56.27 27.77 12.29 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.863 -0.608 . . . . 18.06 110.827 -175.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 79.2 ttt180 . . . . . 0 C--O 1.253 1.279 0 CA-C-O 118.582 -0.723 . . . . 19.51 109.829 -177.324 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' P' P ' 600' ' ' ' A' . . . . . 0.936 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.422 -1.099 0 C4'-C3'-C2' 100.03 -2.67 . 0.0 '__' . 2.3 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' P' P ' 601' ' ' ' U' . . . . . 0.749 " O3'" ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 C2'--C1' 1.538 0.974 1 C4'-C3'-C2' 97.033 -5.667 OUTLIER-EPSILON 0.0 OUTLIER alpha 0.86 . . . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' P' P ' 602' ' ' ' C' . . . . . 0.545 ' P ' ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 O5'--C5' 1.424 -0.98 1 P-O3'-C3' 125.668 4.974 . 0.0 OUTLIER epsilon-1 7.11 . . . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' P' P ' 603' ' ' ' G' . . . . . 0.45 " H3'" H5'' ' P' ' 602' ' ' ' C' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 O4'-C1'-N19 109.794 1.594 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.559 0 N-CA-C 111.863 -0.495 . . . . 9.19 111.863 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.05 105.54 1.38 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-O 120.946 0.403 . . . . 7.69 110.302 178.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 54.3 mtm -81.99 68.6 8.44 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.909 -0.587 . . . . 7.18 111.049 -175.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -92.4 -51.14 5.29 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.259 -0.428 . . . . 4.5 110.597 178.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 57.89 40.02 26.24 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 122.033 0.921 . . . . 4.1 109.843 -177.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.4 p-10 -94.68 67.63 3.3 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 114.409 -1.269 . . . . 1.79 110.41 -177.234 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.454 ' O ' HG23 ' A' ' 11' ' ' VAL . 7.8 m -64.94 130.92 45.17 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.596 -0.729 . . . . 1.33 110.289 177.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.776 ' HG2' ' HB3' ' A' ' 36' ' ' ASN . 50.7 mt-30 -51.43 -47.05 63.13 Favored 'General case' 0 N--CA 1.468 0.465 0 N-CA-C 112.905 0.705 . . . . 1.88 112.905 -167.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.61 -46.7 87.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.407 0.146 . . . . 2.17 110.956 -179.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 42.5 tttm -58.72 -41.63 86.83 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 121.035 0.445 . . . . 2.55 109.962 175.558 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.665 ' O ' HG12 ' A' ' 15' ' ' ILE . 78.3 t -60.03 -57.74 10.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 115.499 -0.773 . . . . 0.39 110.772 178.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.13 -38.23 70.54 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-O 121.291 0.567 . . . . 0.35 111.276 -176.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -66.06 -39.29 89.96 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.434 -0.803 . . . . 0.86 110.665 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -76.71 -38.31 54.56 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 116.119 -0.491 . . . . 2.05 112.038 -176.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.668 HG22 HD23 ' A' ' 19' ' ' LEU . 2.2 mm -61.28 -47.34 93.93 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.225 0 C-N-CA 120.376 -0.529 . . . . 0.33 110.036 -177.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . 0.581 ' HB3' HG21 ' A' ' 27' ' ' ILE . 17.0 p -58.25 -38.51 77.04 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.944 -0.571 . . . . 0.32 110.791 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 60.5 t80 -68.69 -45.16 72.38 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.791 -0.64 . . . . 0.59 110.835 177.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.1 mtp180 -67.01 -43.38 83.02 Favored 'General case' 0 C--N 1.331 -0.211 0 N-CA-C 112.238 0.458 . . . . 2.83 112.238 -175.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.668 HD23 HG22 ' A' ' 15' ' ' ILE . 3.6 mm? -79.41 -9.8 59.67 Favored 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 120.566 -0.454 . . . . 0.99 111.249 178.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 26.8 mt-30 53.59 31.23 12.15 Favored 'General case' 0 C--O 1.232 0.182 0 N-CA-C 108.531 -0.914 . . . . 1.6 108.531 -170.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.615 ' OE1' ' HB ' ' A' ' 27' ' ' ILE . 19.6 tt0 -69.34 130.13 91.18 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 114.124 -1.398 . . . . 1.31 112.073 -169.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.542 ' HD2' ' O4 ' ' P' ' 601' ' ' ' U' . 43.4 Cg_endo -64.41 -54.84 0.69 Allowed 'Trans proline' 0 N--CA 1.475 0.385 0 C-N-CA 124.352 3.368 . . . . 0.41 113.238 176.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.522 ' HE3' ' H5 ' ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -85.61 67.89 10.23 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-O 121.918 0.866 . . . . 1.41 110.657 -176.848 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.475 ' O ' HG22 ' A' ' 27' ' ' ILE . 77.1 mttt -62.9 -19.69 64.44 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.518 -1.219 . . . . 1.75 112.143 -172.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -58.39 -41.62 85.26 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.195 0.521 . . . . 2.14 110.119 174.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.772 HD21 ' HA ' ' A' ' 89' ' ' PHE . 1.6 tm? -73.1 -42.93 62.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.431 -0.804 . . . . 1.33 110.811 -176.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.615 ' HB ' ' OE1' ' A' ' 21' ' ' GLU . 5.1 tp -61.32 -32.17 52.38 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 CA-C-O 120.916 0.388 . . . . 0.44 110.375 -177.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ALA . . . . . 0.562 ' O ' ' HB ' ' A' ' 31' ' ' VAL . . . -75.25 -35.15 61.44 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 116.235 -0.439 . . . . 0.21 110.881 174.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 14.2 ttm-85 -62.31 -41.12 98.26 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.34 -0.391 . . . . 1.48 111.21 179.685 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.571 ' O ' HG12 ' A' ' 34' ' ' ILE . 28.8 t -53.83 -45.25 62.3 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.192 0 CA-C-O 121.307 0.575 . . . . 1.1 109.595 178.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.562 ' HB ' ' O ' ' A' ' 28' ' ' ALA . 93.5 t -53.21 -51.69 37.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-N 114.503 -1.226 . . . . 0.22 110.748 174.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -59.67 -42.64 93.33 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.027 -0.988 . . . . 3.75 111.709 -177.108 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.445 HG13 HG12 ' A' ' 88' ' ' ILE . 45.1 mm -74.99 -53.03 17.29 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 N-CA-C 112.882 0.697 . . . . 0.8 112.882 -173.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.571 HG12 ' O ' ' A' ' 30' ' ' VAL . 29.8 pt -95.71 -7.63 9.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 N-CA-C 112.192 0.441 . . . . 0.4 112.192 -172.066 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 102.07 161.91 26.56 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.345 -0.931 . . . . 0.26 112.392 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . 0.776 ' HB3' ' HG2' ' A' ' 8' ' ' GLN . 13.8 p-10 -63.84 -42.31 97.63 Favored 'General case' 0 C--N 1.323 -0.549 0 C-N-CA 122.377 0.271 . . . . 0.91 111.601 -177.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.43 ' O ' ' HG2' ' A' ' 41' ' ' GLU . 39.5 ttpt -67.33 -50.42 60.12 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 121.051 -0.26 . . . . 3.19 111.019 -175.396 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.549 ' HB3' HD12 ' A' ' 34' ' ' ILE . 12.2 mmmt -61.47 -26.43 67.88 Favored 'General case' 0 C--N 1.33 -0.252 0 N-CA-C 111.66 0.244 . . . . 2.45 111.66 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.483 ' O ' HD23 ' A' ' 43' ' ' LEU . . . -67.36 -47.66 69.75 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 110.01 -0.367 . . . . 0.29 110.01 176.07 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ILE . . . . . 0.653 ' HA ' HD21 ' A' ' 43' ' ' LEU . 49.4 mm -66.35 -38.15 81.19 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 CA-C-O 120.986 0.422 . . . . 1.13 110.219 177.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 0.43 ' HG2' ' O ' ' A' ' 37' ' ' LYS . 32.9 mm-40 -55.9 -38.89 70.81 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.814 -0.63 . . . . 2.1 110.051 174.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.687 HD22 ' HB3' ' A' ' 73' ' ' LEU . 22.0 mt -62.88 -43.42 98.85 Favored 'General case' 0 C--O 1.225 -0.198 0 CA-C-N 116.161 -0.472 . . . . 0.29 112.093 -178.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.653 HD21 ' HA ' ' A' ' 40' ' ' ILE . 0.1 OUTLIER -64.19 -28.58 69.84 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 119.579 -0.849 . . . . 1.36 111.094 178.895 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 93.2 mtp -73.9 -36.89 64.79 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.142 0.496 . . . . 2.2 110.002 170.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.493 ' HB2' ' HA ' ' A' ' 42' ' ' LEU . 36.3 mt-10 -65.77 -25.54 67.31 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 115.659 -0.7 . . . . 1.83 111.706 177.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.635 HG22 HD11 ' A' ' 73' ' ' LEU . 68.5 p -55.35 -40.0 70.72 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.868 0.366 . . . . 1.03 110.116 176.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -60.92 -32.86 72.34 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.829 -0.623 . . . . 0.88 110.859 178.366 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.473 ' HA ' ' HG3' ' A' ' 51' ' ' GLN . 29.1 mt-10 -71.41 -27.99 63.68 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.101 -0.5 . . . . 2.51 109.93 178.365 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 56.7 t -69.23 -43.25 81.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-O 121.118 0.485 . . . . 0.76 109.767 170.311 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.591 ' HG2' ' O ' ' A' ' 46' ' ' THR . 4.6 mm-40 -55.83 -42.99 76.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.42 -0.809 . . . . 1.96 110.44 178.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.473 ' HG3' ' HA ' ' A' ' 48' ' ' GLU . 5.3 pp0? -82.55 -19.02 39.4 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.106 -0.497 . . . . 2.25 111.686 -176.408 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -87.87 -26.7 22.63 Favored 'General case' 0 N--CA 1.464 0.261 0 N-CA-C 112.271 0.471 . . . . 2.34 112.271 -171.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.95 -12.54 2.37 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 119.967 -1.111 . . . . 1.33 113.29 177.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 114.33 -133.18 10.95 Favored Glycine 0 N--CA 1.444 -0.801 0 C-N-CA 120.093 -1.051 . . . . 0.89 114.81 171.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 1.072 HD11 HG23 ' A' ' 57' ' ' ILE . 0.6 OUTLIER -162.83 131.94 4.16 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 122.599 0.36 . . . . 1.38 110.895 -163.467 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PHE . . . . . 0.632 ' N ' HD22 ' A' ' 55' ' ' LEU . 34.6 t80 -116.74 110.55 18.58 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.269 -1.012 . . . . 2.87 108.269 168.716 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 1.072 HG23 HD11 ' A' ' 55' ' ' LEU . 0.0 OUTLIER -77.73 -178.41 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.405 0 N-CA-C 113.375 0.88 . . . . 0.68 113.375 -170.444 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.776 ' HE3' " O3'" ' P' ' 601' ' ' ' U' . 0.0 OUTLIER -50.92 -46.53 60.84 Favored 'General case' 0 C--N 1.343 0.325 0 CA-C-N 115.801 -0.636 . . . . 0.91 111.345 -177.206 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.619 HD21 ' HB3' ' A' ' 61' ' ' SER . 0.9 OUTLIER -92.8 -36.74 12.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.081 -0.509 . . . . 2.28 110.212 176.423 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.486 ' H ' HG13 ' A' ' 57' ' ' ILE . . . 84.22 -19.69 16.81 Favored Glycine 0 CA--C 1.52 0.39 0 N-CA-C 114.598 0.599 . . . . 1.21 114.598 169.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.619 ' HB3' HD21 ' A' ' 59' ' ' ASN . 8.4 t -66.7 -45.61 78.22 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 117.377 0.589 . . . . 2.18 110.412 -178.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.549 ' O ' HD11 ' A' ' 57' ' ' ILE . 20.0 ttt180 -85.48 42.09 0.93 Allowed 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.699 0.761 . . . . 2.89 109.687 177.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 12.0 ptt180 -46.95 132.04 11.9 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.477 -1.238 . . . . 3.59 113.076 -173.201 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.732 ' HD3' ' N ' ' A' ' 55' ' ' LEU . 19.2 mmm180 68.42 57.97 0.44 Allowed 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 114.754 -1.112 . . . . 1.98 112.238 175.142 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' THR . . . . . 0.667 HG23 ' HA3' ' A' ' 68' ' ' GLY . 5.3 t -82.73 144.69 49.02 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 114.779 -1.1 . . . . 0.44 108.19 169.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . 0.561 ' O ' HD12 ' A' ' 19' ' ' LEU . 9.2 Cg_endo -46.45 -60.35 0.9 Allowed 'Trans proline' 0 N--CA 1.483 0.874 0 C-N-CA 123.825 3.017 . . . . 0.44 113.746 -173.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.714 ' HA3' ' O4 ' ' P' ' 601' ' ' ' U' . . . -65.25 -37.22 93.74 Favored Glycine 0 C--O 1.224 -0.519 0 C-N-CA 120.264 -0.97 . . . . 0.25 111.163 177.311 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.667 ' HA3' HG23 ' A' ' 65' ' ' THR . . . -56.37 -32.88 61.07 Favored Glycine 0 N--CA 1.451 -0.314 0 CA-C-N 115.123 -0.539 . . . . 0.3 112.705 178.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.577 HG23 ' O ' ' A' ' 65' ' ' THR . 48.3 t -62.6 -40.69 89.27 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-O 121.226 0.536 . . . . 0.74 109.729 176.318 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . 0.543 ' O ' ' HB2' ' A' ' 73' ' ' LEU . 12.5 t80 -65.24 -36.99 85.85 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.53 -0.759 . . . . 0.26 109.993 174.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.736 ' HB2' " O5'" ' P' ' 600' ' ' ' A' . 0.1 OUTLIER -57.54 -43.53 84.46 Favored 'General case' 0 CA--C 1.516 -0.363 0 N-CA-C 108.177 -1.046 . . . . 0.32 108.177 177.779 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.497 ' HB2' HD23 ' A' ' 55' ' ' LEU . 60.4 t30 -55.93 -26.42 47.72 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 123.73 0.643 . . . . 1.08 110.924 -178.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.687 ' HB3' HD22 ' A' ' 42' ' ' LEU . 77.0 mt -56.39 -41.59 76.54 Favored 'General case' 0 C--O 1.217 -0.64 0 CA-C-N 116.024 -0.535 . . . . 0.46 111.297 179.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.877 ' HB3' HG23 ' A' ' 85' ' ' ILE . 6.5 mp -62.47 -19.02 63.12 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.014 0.435 . . . . 1.08 110.784 178.525 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LYS . . . . . 0.405 ' HG2' ' C5 ' ' P' ' 600' ' ' ' A' . 1.1 mppt? -91.62 -23.37 19.88 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 111.729 0.27 . . . . 1.93 111.729 178.607 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -114.64 -11.99 12.28 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.675 0.274 . . . . 2.12 111.446 -173.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.749 HG21 HD12 ' A' ' 80' ' ' ILE . 5.5 t -60.24 132.75 90.35 Favored Pre-proline 0 C--N 1.325 -0.465 0 CA-C-O 121.661 0.743 . . . . 0.94 111.281 -172.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 77' ' ' THR . 3.4 Cg_exo -74.3 -36.97 2.8 Favored 'Trans proline' 0 CA--C 1.533 0.457 0 C-N-CA 123.536 2.824 . . . . 1.0 114.676 -167.246 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 39.6 m -111.88 17.59 19.62 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 114.135 1.161 . . . . 1.49 114.135 -168.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.749 HD12 HG21 ' A' ' 77' ' ' THR . 44.0 mt -115.2 134.03 59.58 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 118.289 0.495 . . . . 1.21 110.523 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 41.2 m -75.9 143.98 41.39 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-O 121.651 0.739 . . . . 1.79 111.562 -177.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.424 ' HA ' HD12 ' A' ' 85' ' ' ILE . 42.8 tt0 -52.58 -45.38 66.44 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 114.061 -1.427 . . . . 2.89 113.632 -168.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -68.82 -42.12 77.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 120.944 -0.302 . . . . 2.06 110.919 -177.826 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 21.6 tp60 -59.32 -31.71 69.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.46 0.647 . . . . 2.31 110.001 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ILE . . . . . 0.877 HG23 ' HB3' ' A' ' 74' ' ' LEU . 97.3 mt -66.86 -45.85 86.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-N 114.776 -1.102 . . . . 1.41 111.404 177.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 90' ' ' TYR . 14.0 ttmm -56.27 -39.52 72.75 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 115.889 -0.596 . . . . 2.45 111.083 -176.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -66.65 -31.69 72.53 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.562 -0.745 . . . . 1.7 112.622 -173.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.445 HG12 HG13 ' A' ' 33' ' ' ILE . 43.3 mt -69.87 -72.03 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 N-CA-C 112.359 0.503 . . . . 0.42 112.359 -173.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.799 ' HE1' HO2' ' P' ' 600' ' ' ' A' . 9.9 p90 -95.59 -20.98 18.54 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 112.634 0.605 . . . . 0.75 112.634 -164.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 90.7 t80 -93.77 -10.38 34.37 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 116.298 -0.41 . . . . 1.13 111.865 -165.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 54.5 mt -91.88 -71.88 0.51 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.686 -0.405 . . . . 0.86 111.768 -176.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 45.37 -97.72 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 112.877 0.695 . . . . 2.67 112.877 -174.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -79.49 -37.01 37.73 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 111.875 0.324 . . . . 4.7 111.875 -175.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -81.67 73.76 8.7 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.348 0.594 . . . . 3.67 110.342 -176.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 94.4 mttt -76.18 -65.45 0.92 Allowed 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.365 -0.834 . . . . 7.97 110.828 -179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -168.64 85.96 0.18 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.828 -0.623 . . . . 7.59 109.939 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 40.2 m-85 -89.63 43.07 1.12 Allowed 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 120.998 0.428 . . . . 8.84 110.989 -178.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -81.39 58.97 3.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.236 0.541 . . . . 10.06 110.341 179.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.482 ' HB2' ' NH1' ' A' ' 104' ' ' ARG . 0.1 OUTLIER -87.68 164.19 16.14 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.688 -0.687 . . . . 12.32 110.094 179.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.42 ' HB2' ' HE3' ' A' ' 100' ' ' LYS . 21.1 ptmt -96.92 144.93 26.37 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 109.74 -0.467 . . . . 14.02 109.74 176.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -113.15 77.58 1.06 Allowed 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.131 0.491 . . . . 15.92 110.591 -175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -129.98 -78.53 0.54 Allowed 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.867 -0.606 . . . . 17.13 110.107 177.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -97.95 60.0 1.45 Allowed 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.254 0.55 . . . . 18.06 110.147 177.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ARG . . . . . 0.482 ' NH1' ' HB2' ' A' ' 99' ' ' ASN . 41.3 ttm180 . . . . . 0 C--O 1.246 0.916 0 CA-C-N 115.485 -0.78 . . . . 19.51 110.061 -178.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 600' ' ' ' A' . . . . . 0.962 " H4'" HG22 ' A' ' 57' ' ' ILE . . . . . . . . 0 O5'--C5' 1.423 -1.086 0 C4'-C3'-C2' 101.179 -1.521 . 0.0 '__' . 2.3 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' P' P ' 601' ' ' ' U' . . . . . 0.776 " O3'" ' HE3' ' A' ' 58' ' ' MET . . . . . . . . 0 C3'--C2' 1.509 -1.435 1 C4'-C3'-C2' 96.395 -6.305 OUTLIER-DELTA 0.0 OUTLIER delta 0.86 . . . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' P' P ' 602' ' ' ' C' . . . . . 0.563 " O5'" ' HB3' ' A' ' 59' ' ' ASN . . . . . . . . 0 O5'--C5' 1.426 -0.876 0 C4'-C3'-C2' 106.051 3.351 OUTLIER-DELTA 0.0 OUTLIER delta-1 7.11 . . . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' P' P ' 603' ' ' ' G' . . . . . 0.547 " H5'" ' N3 ' ' P' ' 603' ' ' ' G' . . . . . . . . 0 O5'--C5' 1.424 -1.015 0 O4'-C1'-C2' 107.403 0.717 . 0.0 OUTLIER . 7.45 . . . . . . . . . . 2 2 . 1 stop_ save_